Vitas-M small molecule compound
(2E)-3-(4-methoxyphenyl)-1-{2-[(4-methylbenzyl)sulfanyl]-1H-benzimidazol-1-yl}prop-2-en-1-one
Catalog ID
STK702513
SMILES COc1ccc(cc1)/C=C/C(=O)n1c(SCc2ccc(cc2)C)nc2c1cccc2
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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 C25H22N2O2S MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O2S/c1-18-7-9-20(10-8-18)17-30-25-26-22-5-3-4-6-23(22)27(25)24(28)16-13-19-11-14-21(29-2)15-12-19/h3-16H,17H2,1-2H3/b16-13+InChIKey
HTMIKOVXGKHVCT-DTQAZKPQSA-NSynonyms
(2E)3(4methoxyphenyl)1(2((4methylbenzyl)sulfanyl)1Hbenzimidazol1yl)prop2en1one
(E)3(4methoxyphenyl)1(2((4methylbenzyl)thio)1Hbenzo(d)imidazol1yl)prop2en1one
(E)3(4METHOXYPHENYL)1(2((4METHYLPHENYL)METHYLSULFANYL)BENZIMIDAZOL1YL)PROP2EN1ONE
CC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2C(=O)C=CC4=CC=C(C=C4)OC
COc1ccc(cc1)C=CC(=O)n1c(SCc2ccc(cc2)C)nc2c1cccc2
InChI=1SC25H22N2O2Sc1187920(10818)1730252622534623(22)27(25)24(28)161319111421(292)151219h316H17H212H3b1613+
MFCD02990494
ZINC000004813290
ZINC04813290
ZINC4813290
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