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

Systemtic Name: (8-methyl-6-propyl-benzo[b][1,4]benzothiazepin-3-yl)-pyrrolidin-1-yl-methanone Openeye Name: (8-methyl-6-propyl-benzo[b][1,4]benzothiazepin-3-yl)-pyrrolidin-1-yl-methanone CAS Name: (8-methyl-6-propyl-3-benzo[b][1,4]benzothiazepinyl)-(1-pyrrolidinyl)methanone IUPAC Name: (8-methyl-6-propylbenzo[b][1,4]benzothiazepin-3-yl)-pyrrolidin-1-ylmethanone Traditional Name: (8-methyl-6-propyl-benzo[b][1,4]benzothiazepin-3-yl)-pyrrolidino-methanone Formula: C22H24N2OS MolecularWeight: 364.50376

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=CC(=C2)C(=O)N3CCCC3)SC4=C1C=C(C=C4)C

Isomeric SMILES

CCCC1=NC2=C(C=CC(=C2)C(=O)N3CCCC3)SC4=C1C=C(C=C4)C

InChI

InChI=1S/C22H24N2OS/c1-3-6-18-17-13-15(2)7-9-20(17)26-21-10-8-16(14-19(21)23-18)22(25)24-11-4-5-12-24/h7-10,13-14H,3-6,11-12H2,1-2H3