N-(4-methylphenyl)-1-phenyl-2,3,6,7,8,9-hexahydro-4,1-benzothiazepin-5-imine

Systemtic Name: N-(4-methylphenyl)-1-phenyl-2,3,6,7,8,9-hexahydro-4,1-benzothiazepin-5-imine Openeye Name: 1-phenyl-N-(p-tolyl)-2,3,6,7,8,9-hexahydro-4,1-benzothiazepin-5-imine CAS Name: N-(4-methylphenyl)-1-phenyl-2,3,6,7,8,9-hexahydro-4,1-benzothiazepin-5-imine IUPAC Name: N-(4-methylphenyl)-1-phenyl-2,3,6,7,8,9-hexahydro-4,1-benzothiazepin-5-imine Traditional Name: (1-phenyl-2,3,6,7,8,9-hexahydro-4,1-benzothiazepin-5-ylidene)-(p-tolyl)amine Formula: C22H24N2S MolecularWeight: 348.50436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C2C3=C(CCCC3)N(CCS2)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N=C2C3=C(CCCC3)N(CCS2)C4=CC=CC=C4

InChI

InChI=1S/C22H24N2S/c1-17-11-13-18(14-12-17)23-22-20-9-5-6-10-21(20)24(15-16-25-22)19-7-3-2-4-8-19/h2-4,7-8,11-14H,5-6,9-10,15-16H2,1H3