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4-Acetyl 2-(N-phenylacetamido)-5-[3-(4-methylphenyl)sydnon-4-yl]-4,5-dihydro[1,3,4]thiadiazole
SpectraBase Compound ID H8Z84guwGCy
InChI InChI=1S/C21H19N5O4S/c1-13-9-11-17(12-10-13)26-18(20(29)30-23-26)19-25(15(3)28)22-21(31-19)24(14(2)27)16-7-5-4-6-8-16/h4-12,19H,1-3H3
InChIKey RHWFTTKXMOOMKB-UHFFFAOYSA-N
Mol Weight 437.47 g/mol
Molecular Formula C21H19N5O4S
Exact Mass 437.115775 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DPTMpo1zner
Name 4-Acetyl 2-(N-phenylacetamido)-5-[3-(4-methylphenyl)sydnon-4-yl]-4,5-dihydro[1,3,4]thiadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N5O4S
InChI InChI=1S/C21H19N5O4S/c1-13-9-11-17(12-10-13)26-18(20(29)30-23-26)19-25(15(3)28)22-21(31-19)24(14(2)27)16-7-5-4-6-8-16/h4-12,19H,1-3H3
InChIKey RHWFTTKXMOOMKB-UHFFFAOYSA-N
Molecular Weight 437.474 g/mol
SMILES C1(c2[n+](noc2[O-])-c2ccc(cc2)C)N(N=C(S1)N(C(=O)C)c1ccccc1)C(=O)C
SPLASH splash10-00b9-0982300000-fa9eb7a24acf728921a4
Source of Spectrum KC-61-10922-6
Wiley ID 1631225