7-methoxy-4-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]-3,5-dihydro-2H-1,4-benzothiazepine

Systemtic Name: 7-methoxy-4-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]-3,5-dihydro-2H-1,4-benzothiazepine Openeye Name: 4-[3-(4-benzyl-1-piperidyl)propyl]-7-methoxy-3,5-dihydro-2H-1,4-benzothiazepine CAS Name: 7-methoxy-4-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]-3,5-dihydro-2H-1,4-benzothiazepine IUPAC Name: 4-[3-(4-benzylpiperidin-1-yl)propyl]-7-methoxy-3,5-dihydro-2H-1,4-benzothiazepine Traditional Name: 4-[3-(4-benzylpiperidino)propyl]-7-methoxy-3,5-dihydro-2H-1,4-benzothiazepine Formula: C25H34N2OS MolecularWeight: 410.61526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SCCN(C2)CCCN3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)SCCN(C2)CCCN3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H34N2OS/c1-28-24-8-9-25-23(19-24)20-27(16-17-29-25)13-5-12-26-14-10-22(11-15-26)18-21-6-3-2-4-7-21/h2-4,6-9,19,22H,5,10-18,20H2,1H3