8-chloranyl-3-methyl-5-[4-(phenylmethylsulfanyl)phenyl]-1,2,4,5-tetrahydro-3-benzazepin-7-ol

Systemtic Name: 8-chloranyl-3-methyl-5-[4-(phenylmethylsulfanyl)phenyl]-1,2,4,5-tetrahydro-3-benzazepin-7-ol Openeye Name: 5-(4-benzylsulfanylphenyl)-8-chloro-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol CAS Name: 8-chloro-3-methyl-5-[4-(phenylmethylthio)phenyl]-1,2,4,5-tetrahydro-3-benzazepin-7-ol IUPAC Name: 5-(4-benzylsulfanylphenyl)-8-chloro-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol Traditional Name: 5-[4-(benzylthio)phenyl]-8-chloro-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol Formula: C24H24ClNOS MolecularWeight: 409.97146

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC(=C(C=C2C(C1)C3=CC=C(C=C3)SCC4=CC=CC=C4)O)Cl

Isomeric SMILES

CN1CCC2=CC(=C(C=C2C(C1)C3=CC=C(C=C3)SCC4=CC=CC=C4)O)Cl

InChI

InChI=1S/C24H24ClNOS/c1-26-12-11-19-13-23(25)24(27)14-21(19)22(15-26)18-7-9-20(10-8-18)28-16-17-5-3-2-4-6-17/h2-10,13-14,22,27H,11-12,15-16H2,1H3