Vitas-M small molecule compound
2-{[4-methyl-5-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methyl-5-nitrophenyl)acetamide
Catalog ID
STK125640
SMILES O=C(Nc1cc(ccc1C)[N+](=O)[O-])CSc1nnc(n1C)c1ccccc1C
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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 C19H19N5O3S MW 397.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O3S/c1-12-6-4-5-7-15(12)18-21-22-19(23(18)3)28-11-17(25)20-16-10-14(24(26)27)9-8-13(16)2/h4-10H,11H2,1-3H3,(H,20,25)InChIKey
PVLYDGVVMMUIGQ-UHFFFAOYSA-NSynonyms
2((4METHYL5(2METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(2METHYL5NITROPHENYL)ACETAMIDE
2((4METHYL5(2METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N(2METHYL5NITROPHENYL)ACETAMIDE
2(4METHYL5(2METHYLPHENYL)(124TRIAZOL3YLTHIO))N(2METHYL5NITROPHENYL)ACETAMIDE
CC1=C(C=C(C=C1)(N+)(=O)(O))NC(=O)CSC2=NN=C(N2C)C3=CC=CC=C3C
InChI=1SC19H19N5O3Sc112645715(12)18212219(23(18)3)281117(25)20161014(24(26)27)9813(16)2h410H11H213H3(H2025)
MFCD02225869
O=C(Nc1cc(ccc1C)(N+)(=O)(O))CSc1nnc(n1C)c1ccccc1C
ZINC000000869059
ZINC00869059
ZINC869059
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