Vitas-M small molecule compound
ethyl 6-ethyl-2-[({6-methyl-2-[4-(propan-2-yl)phenyl]quinolin-4-yl}carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK431007
SMILES CCOC(=O)c1c(NC(=O)c2cc(nc3c2cc(C)cc3)c2ccc(cc2)C(C)C)sc2c1CCC(C2)CC
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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 C33H36N2O3S MW 540.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H36N2O3S/c1-6-21-9-14-24-29(17-21)39-32(30(24)33(37)38-7-2)35-31(36)26-18-28(23-12-10-22(11-13-23)19(3)4)34-27-15-8-20(5)16-25(26)27/h8,10-13,15-16,18-19,21H,6-7,9,14,17H2,1-5H3,(H,35,36)InChIKey
OLMAGFMJZJOBSB-UHFFFAOYSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3=CC(=NC4=C3C=C(C=C4)C)C5=CC=C(C=C5)C(C)C
ethyl6ethyl2(((6methyl2(4(propan2yl)phenyl)quinolin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6ethyl2((6methyl2(4propan2ylphenyl)quinoline4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC33H36N2O3Sc16219142429(1721)3932(30(24)33(37)3872)3531(36)261828(23121022(111323)19(3)4)342715820(5)1625(26)27h810131516181921H6791417H215H3(H3536)
MFCD03465824
ZINC000002738215
ZINC000002738216
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