Vitas-M small molecule compound
1-[{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}(2-methylbenzyl)amino]-N-(4-methoxyphenyl)cyclohexanecarboxamide
Catalog ID
STL446849
SMILES COc1ccc(cc1)NC(=O)C1(CCCCC1)N(C(=O)CSc1nc(C)cc(n1)C)Cc1ccccc1C
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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 C30H36N4O3S MW 532.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H36N4O3S/c1-21-10-6-7-11-24(21)19-34(27(35)20-38-29-31-22(2)18-23(3)32-29)30(16-8-5-9-17-30)28(36)33-25-12-14-26(37-4)15-13-25/h6-7,10-15,18H,5,8-9,16-17,19-20H2,1-4H3,(H,33,36)InChIKey
ZKRKRSOKMPYOQN-UHFFFAOYSA-NSynonyms
1((((46dimethylpyrimidin2yl)sulfanyl)acetyl)(2methylbenzyl)amino)N(4methoxyphenyl)cyclohexanecarboxamide
1((2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)((2METHYLPHENYL)METHYL)AMINO)N(4METHOXYPHENYL)CYCLOHEXANE1CARBOXAMIDE
1(2(46DIMETHYLPYRIMIDIN2YLTHIO)N(2METHYLBENZYL)ACETAMIDO)N(4METHOXYPHENYL)CYCLOHEXANECARBOXAMIDE
CC1=CC=CC=C1CN(C(=O)CSC2=NC(=CC(=N2)C)C)C3(CCCCC3)C(=O)NC4=CC=C(C=C4)OC
InChI=1SC30H36N4O3Sc12110671124(21)1934(27(35)2038293122(2)1823(3)3229)30(168591730)28(36)3325121426(374)151325h67101518H58916171920H214H3(H3336)
MFCD06243979
ZINC000008713232
ZINC8713232
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