Vitas-M small molecule compound
N-{1-[5-({2-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Catalog ID
STK336235
SMILES CCn1c(SCC(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)nnc1C(NC(=O)c1ccccc1)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 C24H27N7O3S MW 493.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N7O3S/c1-5-31-21(15(2)25-22(33)16-9-7-6-8-10-16)27-28-23(31)35-14-20(32)26-17-11-12-18-19(13-17)30(4)24(34)29(18)3/h6-13,15H,5,14H2,1-4H3,(H,25,33)(H,26,32)InChIKey
GGXWGKLUBDKHQX-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)N(C(=O)N3C)C)C(C)NC(=O)C4=CC=CC=C4
InChI=1SC24H27N7O3Sc153121(15(2)2522(33)1697681016)272823(31)351420(32)261711121819(1317)30(4)24(34)29(18)3h61315H514H214H3(H2533)(H2632)
MFCD09964606
N(1(5((2((13DIMETHYL2OXO23DIHYDRO1HBENZIMIDAZOL5YL)AMINO)2OXOETHYL)SULFANYL)4ETHYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
N(1(5(2((13dimethyl2oxobenzimidazol5yl)amino)2oxoethyl)sulfanyl4ethyl124triazol3yl)ethyl)benzamide
ZINC000018201368
ZINC000018201371
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