Vitas-M small molecule compound
N-{[2-(4-ethoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-4-methyl-3-nitrobenzamide
Catalog ID
STK183959
SMILES CCOc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)NC(=S)NC(=O)c1ccc(c(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 C24H22N6O4S MW 490.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N6O4S/c1-4-34-18-9-7-17(8-10-18)29-27-20-11-15(3)19(13-21(20)28-29)25-24(35)26-23(31)16-6-5-14(2)22(12-16)30(32)33/h5-13H,4H2,1-3H3,(H2,25,26,31,35)InChIKey
VJSCALMVWYPPMI-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C4=CC(=C(C=C4)C)(N+)(=O)(O))C
CCOc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)NC(=S)NC(=O)c1ccc(c(c1)(N+)(=O)(O))C
InChI=1SC24H22N6O4Sc1434189717(81018)2927201115(3)19(1321(20)2829)2524(35)2623(31)166514(2)22(1216)30(32)33h513H4H213H3(H225263135)
MFCD02923158
N((2(4ETHOXYPHENYL)6METHYL2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)4METHYL3NITROBENZAMIDE
N((2(4ETHOXYPHENYL)6METHYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)4METHYL3NITROBENZAMIDE
ZINC000002852063
ZINC02852063
ZINC2852063
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