Vitas-M small molecule compound
N-{[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-2-methyl-3-nitrobenzamide
Catalog ID
STK184265
SMILES COc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)NC(=S)NC(=O)c1cccc(c1C)[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 C23H20N6O4S MW 476.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N6O4S/c1-13-11-19-20(27-28(26-19)15-7-9-16(33-3)10-8-15)12-18(13)24-23(34)25-22(30)17-5-4-6-21(14(17)2)29(31)32/h4-12H,1-3H3,(H2,24,25,30,34)InChIKey
LZMMKVWQEBCXOL-UHFFFAOYSA-NSynonyms
CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C3=C(C(=CC=C3)(N+)(=O)(O))C)C4=CC=C(C=C4)OC
COc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)NC(=S)NC(=O)c1cccc(c1C)(N+)(=O)(O)
InChI=1SC23H20N6O4Sc113111920(2728(2619)157916(333)10815)1218(13)2423(34)2522(30)1754621(14(17)2)29(31)32h412H13H3(H224253034)
MFCD03030895
N((2(4METHOXYPHENYL)6METHYL2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)2METHYL3NITROBENZAMIDE
N((2(4METHOXYPHENYL)6METHYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)2METHYL3NITROBENZAMIDE
ZINC000002843863
ZINC02843863
ZINC2843863
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