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8-(2-furanyl)-3,3-dimethyl-6-[4-[(4-nitrophenyl)-oxomethyl]-1-piperazinyl]-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile

View entire compound with spectra: 1 MS (GC)

8-(2-furanyl)-3,3-dimethyl-6-[4-[(4-nitrophenyl)-oxomethyl]-1-piperazinyl]-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile
SpectraBase Compound ID FmGdCLHLR7a
InChI InChI=1S/C26H25N5O4S/c1-26(2)14-19-20(15-27)24(28-23(21(19)16-36-26)22-4-3-13-35-22)29-9-11-30(12-10-29)25(32)17-5-7-18(8-6-17)31(33)34/h3-8,13H,9-12,14,16H2,1-2H3
InChIKey IJNCZSMGKYPFKC-UHFFFAOYSA-N
Mol Weight 503.58 g/mol
Molecular Formula C26H25N5O4S
Exact Mass 503.162725 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVIbVgQqQNd
Name 8-(2-furanyl)-3,3-dimethyl-6-[4-[(4-nitrophenyl)-oxomethyl]-1-piperazinyl]-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H25N5O4S
InChI InChI=1S/C26H25N5O4S/c1-26(2)14-19-20(15-27)24(28-23(21(19)16-36-26)22-4-3-13-35-22)29-9-11-30(12-10-29)25(32)17-5-7-18(8-6-17)31(33)34/h3-8,13H,9-12,14,16H2,1-2H3
InChIKey IJNCZSMGKYPFKC-UHFFFAOYSA-N
Molecular Weight 503.577 g/mol
SMILES c1(c(nc(c2c1CC(SC2)(C)C)-c1occc1)N1CCN(C(c2ccc(N(=O)=O)cc2)=O)CC1)C#N
SPLASH splash10-0h91-8494010000-a781885894e14dd82853
Synonyms 8-(2-furyl)-3,3-dimethyl-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile 8-(2-furyl)-3,3-dimethyl-6-[4-(4-nitrobenzoyl)piperazino]-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile 8-(furan-2-yl)-3,3-dimethyl-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile 8-(furan-2-yl)-3,3-dimethyl-6-[4-(4-nitrophenyl)carbonylpiperazin-1-yl]-1,4-dihydrothiopyrano[3,4-c]pyridine-5-carbonitrile
Wiley ID 1459700