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1-cyclohexyl-2-methyl-5-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methoxy]-3-indolecarboxylic acid ethyl ester
SpectraBase Compound ID 6dIotx6sbWo
InChI InChI=1S/C21H25N3O4S/c1-3-26-20(25)19-13(2)24(14-7-5-4-6-8-14)17-10-9-15(11-16(17)19)27-12-18-22-23-21(29)28-18/h9-11,14H,3-8,12H2,1-2H3,(H,23,29)
InChIKey NKOSHKSZBKPGNZ-UHFFFAOYSA-N
Mol Weight 415.51 g/mol
Molecular Formula C21H25N3O4S
Exact Mass 415.156577 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 347Yj2H21a3
Name 1-cyclohexyl-2-methyl-5-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methoxy]-3-indolecarboxylic acid ethyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25N3O4S
InChI InChI=1S/C21H25N3O4S/c1-3-26-20(25)19-13(2)24(14-7-5-4-6-8-14)17-10-9-15(11-16(17)19)27-12-18-22-23-21(29)28-18/h9-11,14H,3-8,12H2,1-2H3,(H,23,29)
InChIKey NKOSHKSZBKPGNZ-UHFFFAOYSA-N
Molecular Weight 415.508 g/mol
SMILES Sc1oc(COc2cc3c(c([n](c3cc2)C2CCCCC2)C)C(=O)OCC)nn1
SPLASH splash10-0ufr-6029000000-7bd00058d118bce3da37
Source of Spectrum Y1-42-2899-6
Synonyms 1-cyclohexyl-2-methyl-5-[(2-thioxo-3H-1,3,4-oxadiazol-5-yl)methoxy]indole-3-carboxylic acid ethyl ester Ethyl 1-cyclohexyl-2-methyl-5-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methoxy]indole-3-carboxylate Ethyl 1-cyclohexyl-2-methyl-5-[(2-thioxo-3H-1,3,4-oxadiazol-5-yl)methoxy]indole-3-carboxylate
Wiley ID 1565389