Vitas-M small molecule compound
N-(3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(propan-2-yloxy)phenyl]quinoline-4-carboxamide
Catalog ID
STK425135
SMILES CCCC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)OC(C)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 C31H33N3O3S MW 527.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N3O3S/c1-4-7-19-10-15-23-27(16-19)38-31(28(23)29(32)35)34-30(36)24-17-26(33-25-9-6-5-8-22(24)25)20-11-13-21(14-12-20)37-18(2)3/h5-6,8-9,11-14,17-19H,4,7,10,15-16H2,1-3H3,(H2,32,35)(H,34,36)InChIKey
BMQZVPRESBZIRL-UHFFFAOYSA-NSynonyms
CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)OC(C)C
InChI=1SC31H33N3O3Sc1471910152327(1619)3831(28(23)29(32)35)3430(36)241726(3325965822(24)25)20111321(141220)3718(2)3h568911141719H47101516H213H3(H23235)(H3436)
MFCD02375422
N(3carbamoyl6propyl4567tetrahydro1benzothiophen2yl)2(4(propan2yloxy)phenyl)quinoline4carboxamide
N(3carbamoyl6propyl4567tetrahydro1benzothiophen2yl)2(4propan2yloxyphenyl)quinoline4carboxamide
ZINC000002773968
ZINC000002773969
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