Vitas-M small molecule compound
2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-{1-(4-fluorophenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}-N-(4-methoxybenzyl)acetamide
Catalog ID
STL446854
SMILES COc1ccc(cc1)CN(C(C(=O)Nc1ccc(cc1)OC)c1ccc(cc1)F)C(=O)CSc1nc(C)cc(n1)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 C31H31FN4O4S MW 574.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31FN4O4S/c1-20-17-21(2)34-31(33-20)41-19-28(37)36(18-22-5-13-26(39-3)14-6-22)29(23-7-9-24(32)10-8-23)30(38)35-25-11-15-27(40-4)16-12-25/h5-17,29H,18-19H2,1-4H3,(H,35,38)InChIKey
FAXFNNUANQTHRS-UHFFFAOYSA-NSynonyms
2((2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)((4METHOXYPHENYL)METHYL)AMINO)2(4FLUOROPHENYL)N(4METHOXYPHENYL)ACETAMIDE
2((46dimethylpyrimidin2yl)sulfanyl)N(1(4fluorophenyl)2((4methoxyphenyl)amino)2oxoethyl)N(4methoxybenzyl)acetamide
2(46DIMETHYLPYRIMIDIN2YLTHIO)N(1(4FLUOROPHENYL)2(4METHOXYPHENYLAMINO)2OXOETHYL)N(4METHOXYBENZYL)ACETAMIDE
CC1=CC(=NC(=N1)SCC(=O)N(CC2=CC=C(C=C2)OC)C(C3=CC=C(C=C3)F)C(=O)NC4=CC=C(C=C4)OC)C
InChI=1SC31H31FN4O4Sc1201721(2)3431(3320)411928(37)36(182251326(393)14622)29(237924(32)10823)30(38)3525111527(404)161225h51729H1819H214H3(H3538)
MFCD06243984
ZINC000008713240
ZINC000008713242
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