Vitas-M small molecule compound
methyl 6-ethyl-2-({[2-(3-methylphenyl)quinolin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK419670
SMILES CCC1CCc2c(C1)sc(c2C(=O)OC)NC(=O)c1cc(nc2c1cccc2)c1cccc(c1)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 C29H28N2O3S MW 484.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O3S/c1-4-18-12-13-21-25(15-18)35-28(26(21)29(33)34-3)31-27(32)22-16-24(19-9-7-8-17(2)14-19)30-23-11-6-5-10-20(22)23/h5-11,14,16,18H,4,12-13,15H2,1-3H3,(H,31,32)InChIKey
CXRXVJVPIACCRR-UHFFFAOYSA-NSynonyms
438475-61-7438475617
CCC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)C
InChI=1SC29H28N2O3Sc141812132125(1518)3528(26(21)29(33)343)3127(32)221624(1997817(2)1419)302311651020(22)23h511141618H4121315H213H3(H3132)
methyl6ethyl2(((2(3methylphenyl)quinolin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6ethyl2((2(3methylphenyl)quinoline4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD02371998
ZINC000002753236
ZINC000002753237
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