(6,8-dimethylbenzo[b][1,4]benzothiazepin-3-yl)-pyrrolidin-1-yl-methanone

Systemtic Name: (6,8-dimethylbenzo[b][1,4]benzothiazepin-3-yl)-pyrrolidin-1-yl-methanone Openeye Name: (6,8-dimethylbenzo[b][1,4]benzothiazepin-3-yl)-pyrrolidin-1-yl-methanone CAS Name: (6,8-dimethyl-3-benzo[b][1,4]benzothiazepinyl)-(1-pyrrolidinyl)methanone IUPAC Name: (6,8-dimethylbenzo[b][1,4]benzothiazepin-3-yl)-pyrrolidin-1-ylmethanone Traditional Name: (6,8-dimethylbenzo[b][1,4]benzothiazepin-3-yl)-pyrrolidino-methanone Formula: C20H20N2OS MolecularWeight: 336.4506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC3=C(C=C(C=C3)C(=O)N4CCCC4)N=C2C

Isomeric SMILES

CC1=CC2=C(C=C1)SC3=C(C=C(C=C3)C(=O)N4CCCC4)N=C2C

InChI

InChI=1S/C20H20N2OS/c1-13-5-7-18-16(11-13)14(2)21-17-12-15(6-8-19(17)24-18)20(23)22-9-3-4-10-22/h5-8,11-12H,3-4,9-10H2,1-2H3