methyl 5-[2-[4-(1H-indol-3-yl)piperidin-1-yl]ethyl]-4-phenyl-1,3-thiazole-2-carboxylate

Systemtic Name: methyl 5-[2-[4-(1H-indol-3-yl)piperidin-1-yl]ethyl]-4-phenyl-1,3-thiazole-2-carboxylate Openeye Name: methyl 5-[2-[4-(1H-indol-3-yl)-1-piperidyl]ethyl]-4-phenyl-thiazole-2-carboxylate CAS Name: 5-[2-[4-(1H-indol-3-yl)-1-piperidinyl]ethyl]-4-phenyl-2-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 5-[2-[4-(1H-indol-3-yl)piperidin-1-yl]ethyl]-4-phenyl-1,3-thiazole-2-carboxylate Traditional Name: 5-[2-[4-(1H-indol-3-yl)piperidino]ethyl]-4-phenyl-thiazole-2-carboxylic acid methyl ester Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(=C(S1)CCN2CCC(CC2)C3=CNC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=NC(=C(S1)CCN2CCC(CC2)C3=CNC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C26H27N3O2S/c1-31-26(30)25-28-24(19-7-3-2-4-8-19)23(32-25)13-16-29-14-11-18(12-15-29)21-17-27-22-10-6-5-9-20(21)22/h2-10,17-18,27H,11-16H2,1H3