6-methoxy-N-[1-(phenylmethyl)piperidin-4-yl]-3-phenylsulfanyl-1H-indole-2-carboxamide

Systemtic Name: 6-methoxy-N-[1-(phenylmethyl)piperidin-4-yl]-3-phenylsulfanyl-1H-indole-2-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-6-methoxy-3-phenylsulfanyl-1H-indole-2-carboxamide CAS Name: 6-methoxy-N-[1-(phenylmethyl)-4-piperidinyl]-3-(phenylthio)-1H-indole-2-carboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-6-methoxy-3-phenylsulfanyl-1H-indole-2-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-6-methoxy-3-(phenylthio)-1H-indole-2-carboxamide Formula: C28H29N3O2S MolecularWeight: 471.61376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(N2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)SC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(N2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)SC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O2S/c1-33-22-12-13-24-25(18-22)30-26(27(24)34-23-10-6-3-7-11-23)28(32)29-21-14-16-31(17-15-21)19-20-8-4-2-5-9-20/h2-13,18,21,30H,14-17,19H2,1H3,(H,29,32)