Vitas-M small molecule compound
6-tert-butyl-N-(2,5-dimethoxyphenyl)-2-{[(4-fluorophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK074398
SMILES COc1ccc(cc1NC(=O)c1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1ccc(cc1)F)OC
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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 C28H31FN2O4S MW 510.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31FN2O4S/c1-28(2,3)17-8-12-20-23(14-17)36-27(31-25(32)16-6-9-18(29)10-7-16)24(20)26(33)30-21-15-19(34-4)11-13-22(21)35-5/h6-7,9-11,13,15,17H,8,12,14H2,1-5H3,(H,30,33)(H,31,32)InChIKey
PEALLTNLZKCSFM-UHFFFAOYSA-NSynonyms
6tertbutylN(25dimethoxyphenyl)2(((4fluorophenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxamide
6tertbutylN(25dimethoxyphenyl)2((4fluorobenzoyl)amino)4567tetrahydro1benzothiophene3carboxamide
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3=C(C=CC(=C3)OC)OC)NC(=O)C4=CC=C(C=C4)F
COc1ccc(cc1NC(=O)c1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1ccc(cc1)F)OC
InChI=1SC28H31FN2O4Sc128(23)178122023(1417)3627(3125(32)166918(29)10716)24(20)26(33)30211519(344)111322(21)355h67911131517H81214H215H3(H3033)(H3132)
MFCD03272696
STK074398
ZINC000002182427
ZINC000002182428
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