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1-(4-Cyano-1,5-diphenyl-1H-pyrazole-3-carbonyl)-4-phenylthiosemicarbazide
SpectraBase Compound ID ICoMA0DplsH
InChI InChI=1S/C24H18N6OS/c25-16-20-21(23(31)27-28-24(32)26-18-12-6-2-7-13-18)29-30(19-14-8-3-9-15-19)22(20)17-10-4-1-5-11-17/h1-15H,(H,27,31)(H2,26,28,32)
InChIKey QSNHWYQEYQHBNG-UHFFFAOYSA-N
Mol Weight 438.51 g/mol
Molecular Formula C24H18N6OS
Exact Mass 438.12628 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IdbCM4ZKPxx
Name 1-(4-Cyano-1,5-diphenyl-1H-pyrazole-3-carbonyl)-4-phenylthiosemicarbazide
Alternate Name(s) 2-(4-cyano-1,5-diphenyl-1H-pyrazole-3-carbonyl)-N-phenylhydrazinecarbothioamide 1-[[(4-cyano-1,5-diphenyl-3-pyrazolyl)-oxomethyl]amino]-3-phenylthiourea 1-[(4-cyano-1,5-diphenylpyrazole-3-carbonyl)amino]-3-phenylthiourea 1-[(4-cyano-1,5-diphenyl-pyrazol-3-yl)carbonylamino]-3-phenyl-thiourea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18N6OS
InChI InChI=1S/C24H18N6OS/c25-16-20-21(23(31)27-28-24(32)26-18-12-6-2-7-13-18)29-30(19-14-8-3-9-15-19)22(20)17-10-4-1-5-11-17/h1-15H,(H,27,31)(H2,26,28,32)
InChIKey QSNHWYQEYQHBNG-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200900176
Molecular Weight 438.509 g/mol
SMILES N(NC(Nc1ccccc1)=S)C(=O)c1n[n](c(-c2ccccc2)c1C#N)-c1ccccc1
SPLASH splash10-000i-2000900000-e95c325f40b5e9e556bf
Source of Spectrum APC-343-392-5
Wiley ID 1769076