Vitas-M small molecule compound
1-[{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}(4-fluorobenzyl)amino]-N-(4-methoxyphenyl)cyclohexanecarboxamide
Catalog ID
STL446850
SMILES COc1ccc(cc1)NC(=O)C1(CCCCC1)N(C(=O)CSc1nc(C)cc(n1)C)Cc1ccc(cc1)F
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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 C29H33FN4O3S MW 536.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33FN4O3S/c1-20-17-21(2)32-28(31-20)38-19-26(35)34(18-22-7-9-23(30)10-8-22)29(15-5-4-6-16-29)27(36)33-24-11-13-25(37-3)14-12-24/h7-14,17H,4-6,15-16,18-19H2,1-3H3,(H,33,36)InChIKey
RAUQIYPAJRONJT-UHFFFAOYSA-NSynonyms
1((((46dimethylpyrimidin2yl)sulfanyl)acetyl)(4fluorobenzyl)amino)N(4methoxyphenyl)cyclohexanecarboxamide
1((2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)((4FLUOROPHENYL)METHYL)AMINO)N(4METHOXYPHENYL)CYCLOHEXANE1CARBOXAMIDE
1(2(46DIMETHYLPYRIMIDIN2YLTHIO)N(4FLUOROBENZYL)ACETAMIDO)N(4METHOXYPHENYL)CYCLOHEXANECARBOXAMIDE
CC1=CC(=NC(=N1)SCC(=O)N(CC2=CC=C(C=C2)F)C3(CCCCC3)C(=O)NC4=CC=C(C=C4)OC)C
InChI=1SC29H33FN4O3Sc1201721(2)3228(3120)381926(35)34(18227923(30)10822)29(155461629)27(36)3324111325(373)141224h71417H4615161819H213H3(H3336)
MFCD06243980
ZINC000008713234
ZINC8713234
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