3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(3-methoxy-4-methyl-phenyl)methanone

Systemtic Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(3-methoxy-4-methyl-phenyl)methanone Openeye Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(3-methoxy-4-methyl-phenyl)methanone CAS Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(3-methoxy-4-methylphenyl)methanone IUPAC Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(3-methoxy-4-methylphenyl)methanone Traditional Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(3-methoxy-4-methyl-phenyl)methanone Formula: C18H19NO2S MolecularWeight: 313.41396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCSC3=CC=CC=C32)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCSC3=CC=CC=C32)OC

InChI

InChI=1S/C18H19NO2S/c1-13-8-9-14(12-16(13)21-2)18(20)19-10-5-11-22-17-7-4-3-6-15(17)19/h3-4,6-9,12H,5,10-11H2,1-2H3