Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1Z)-1-(3-nitrophenyl)ethylidene]acetohydrazide
Catalog ID
STK110429
SMILES O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)N/N=C(\c1cccc(c1)[N+](=O)[O-])/C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C29H30N6O3S MW 542.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N6O3S/c1-19-9-15-24(16-10-19)34-27(21-11-13-23(14-12-21)29(3,4)5)32-33-28(34)39-18-26(36)31-30-20(2)22-7-6-8-25(17-22)35(37)38/h6-17H,18H2,1-5H3,(H,31,36)/b30-20-InChIKey
UXVJXAAEMVVUFN-COEJQBHMSA-NSynonyms
488743-62-0(Z)2((5(4(tertbutyl)phenyl)4(ptolyl)4H124triazol3yl)thio)N(1(3nitrophenyl)ethylidene)acetohydrazide
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((Z)1(3NITROPHENYL)ETHYLIDENEAMINO)ACETAMIDE
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((1Z)1(3NITROPHENYL)ETHYLIDENE)ACETOHYDRAZIDE
488743620
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=C(C)C3=CC(=CC=C3)(N+)(=O)(O))C4=CC=C(C=C4)C(C)(C)C
InChI=1SC29H30N6O3Sc11991524(161019)3427(21111323(141221)29(34)5)323328(34)391826(36)313020(2)2276825(1722)35(37)38h617H18H215H3(H3136)b3020
MFCD03219920
N((1Z)2(3NITROPHENYL)1AZAPROP1ENYL)2(5(4(TERTBUTYL)PHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)NN=C(c1cccc(c1)(N+)(=O)(O))C
ZINC000097939495
ZINC101514612
Check stock
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Check stock on Vitas-MAvailable files
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