2-(phenylmethyl)-8-(2-piperidin-4-ylethylsulfinyl)-1,3,4,5-tetrahydro-2-benzazepine

Systemtic Name: 2-(phenylmethyl)-8-(2-piperidin-4-ylethylsulfinyl)-1,3,4,5-tetrahydro-2-benzazepine Openeye Name: 2-benzyl-8-[2-(4-piperidyl)ethylsulfinyl]-1,3,4,5-tetrahydro-2-benzazepine CAS Name: 2-(phenylmethyl)-8-[2-(4-piperidinyl)ethylsulfinyl]-1,3,4,5-tetrahydro-2-benzazepine IUPAC Name: 2-benzyl-8-(2-piperidin-4-ylethylsulfinyl)-1,3,4,5-tetrahydro-2-benzazepine Traditional Name: 2-benzyl-8-[2-(4-piperidyl)ethylsulfinyl]-1,3,4,5-tetrahydro-2-benzazepine Formula: C24H32N2OS MolecularWeight: 396.58868

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CN(C1)CC3=CC=CC=C3)C=C(C=C2)S(=O)CCC4CCNCC4

Isomeric SMILES

C1CC2=C(CN(C1)CC3=CC=CC=C3)C=C(C=C2)S(=O)CCC4CCNCC4

InChI

InChI=1S/C24H32N2OS/c27-28(16-12-20-10-13-25-14-11-20)24-9-8-22-7-4-15-26(19-23(22)17-24)18-21-5-2-1-3-6-21/h1-3,5-6,8-9,17,20,25H,4,7,10-16,18-19H2