Vitas-M small molecule compound

N-{[5-({2-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}-4-methoxybenzamide

Catalog ID
STK261178
SMILES COc1ccc(cc1)C(=O)NCc1nnc(n1C)SCC(=O)Nc1ccc2c(c1)n(C)c(=O)n2C

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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 C23H25N7O4S MW 495.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N7O4S/c1-28-17-10-7-15(11-18(17)29(2)23(28)33)25-20(31)13-35-22-27-26-19(30(22)3)12-24-21(32)14-5-8-16(34-4)9-6-14/h5-11H,12-13H2,1-4H3,(H,24,32)(H,25,31)
InChIKey
BTLTWYWLXTXIOG-UHFFFAOYSA-N
Synonyms

CN1C2=C(C=C(C=C2)NC(=O)CSC3=NN=C(N3C)CNC(=O)C4=CC=C(C=C4)OC)N(C1=O)C
InChI=1SC23H25N7O4Sc1281710715(1118(17)29(2)23(28)33)2520(31)133522272619(30(22)3)122421(32)145816(344)9614h511H1213H214H3(H2432)(H2531)
MFCD08670897
N((5((2((13DIMETHYL2OXO23DIHYDRO1HBENZIMIDAZOL5YL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)4METHOXYBENZAMIDE
N((5(2((13dimethyl2oxobenzimidazol5yl)amino)2oxoethyl)sulfanyl4methyl124triazol3yl)methyl)4methoxybenzamide
N(5((13DIMETHYL2OXO23DIHYDRO1HBENZOIMIDAZOL5YLCARBAMOYL)METHYLSULFANYL)4METHYL4H(124)TRIAZOL3YLMETHYL)4METHOXYBENZAMIDE
ZINC000009426868
ZINC09426868
ZINC9426868

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Available files

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