4-ethyl-5-[1-(phenylmethyl)piperidin-4-yl]-3-sulfanyl-1,2,4,5-tetrahydro-3-benzazepine

Systemtic Name: 4-ethyl-5-[1-(phenylmethyl)piperidin-4-yl]-3-sulfanyl-1,2,4,5-tetrahydro-3-benzazepine Openeye Name: 5-(1-benzyl-4-piperidyl)-4-ethyl-3-sulfanyl-1,2,4,5-tetrahydro-3-benzazepine CAS Name: 4-ethyl-3-mercapto-5-[1-(phenylmethyl)-4-piperidinyl]-1,2,4,5-tetrahydro-3-benzazepine IUPAC Name: 5-(1-benzylpiperidin-4-yl)-4-ethyl-3-sulfanyl-1,2,4,5-tetrahydro-3-benzazepine Traditional Name: 5-(1-benzyl-4-piperidyl)-4-ethyl-3-mercapto-1,2,4,5-tetrahydro-3-benzazepine Formula: C24H32N2S MolecularWeight: 380.58928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C2=CC=CC=C2CCN1S)C3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCC1C(C2=CC=CC=C2CCN1S)C3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H32N2S/c1-2-23-24(22-11-7-6-10-20(22)14-17-26(23)27)21-12-15-25(16-13-21)18-19-8-4-3-5-9-19/h3-11,21,23-24,27H,2,12-18H2,1H3