Vitas-M small molecule compound
N-(2,4-dimethylphenyl)-2-{[5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK710991
SMILES O=C(Nc1ccc(cc1C)C)CSc1nnc([nH]1)c1cccc(c1)[N+](=O)[O-]
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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 C18H17N5O3S MW 383.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5O3S/c1-11-6-7-15(12(2)8-11)19-16(24)10-27-18-20-17(21-22-18)13-4-3-5-14(9-13)23(25)26/h3-9H,10H2,1-2H3,(H,19,24)(H,20,21,22)InChIKey
UGOVGVNQOLBFKU-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)NC(=O)CSC2=NNC(=N2)C3=CC(=CC=C3)(N+)(=O)(O))C
InChI=1SC18H17N5O3Sc1116715(12(2)811)1916(24)1027182017(212218)1343514(913)23(25)26h39H10H212H3(H1924)(H202122)
MFCD13371403
N(24DIMETHYLPHENYL)2((5(3NITROPHENYL)1H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(24dimethylphenyl)2((5(3nitrophenyl)4H124triazol3yl)sulfanyl)acetamide
N(24DIMETHYLPHENYL)2(3(3NITROPHENYL)(1H124TRIAZOL5YLTHIO))ACETAMIDE
O=C(Nc1ccc(cc1C)C)CSc1nnc((nH)1)c1cccc(c1)(N+)(=O)(O)
ZINC000009031124
ZINC09031124
ZINC9031124
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