6-chloranyl-3-methyl-9-phenylsulfanyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol

Systemtic Name: 6-chloranyl-3-methyl-9-phenylsulfanyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol Openeye Name: 6-chloro-3-methyl-9-phenylsulfanyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol CAS Name: 6-chloro-3-methyl-9-(phenylthio)-1,2,4,5-tetrahydro-3-benzazepin-7-ol IUPAC Name: 6-chloro-3-methyl-9-phenylsulfanyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol Traditional Name: 6-chloro-3-methyl-9-(phenylthio)-1,2,4,5-tetrahydro-3-benzazepin-7-ol Formula: C17H18ClNOS MolecularWeight: 319.84892

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C=C(C(=C2CC1)Cl)O)SC3=CC=CC=C3

Isomeric SMILES

CN1CCC2=C(C=C(C(=C2CC1)Cl)O)SC3=CC=CC=C3

InChI

InChI=1S/C17H18ClNOS/c1-19-9-7-13-14(8-10-19)17(18)15(20)11-16(13)21-12-5-3-2-4-6-12/h2-6,11,20H,7-10H2,1H3