2-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone

Systemtic Name: 2-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Openeye Name: 2-(4-chloro-2,5-dimethoxy-anilino)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone CAS Name: 2-(4-chloro-2,5-dimethoxyanilino)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone IUPAC Name: 2-(4-chloro-2,5-dimethoxyanilino)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Traditional Name: 2-(4-chloro-2,5-dimethoxy-anilino)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Formula: C20H23ClN2O3S MolecularWeight: 406.92622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CNC3=CC(=C(C=C3OC)Cl)OC

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CNC3=CC(=C(C=C3OC)Cl)OC

InChI

InChI=1S/C20H23ClN2O3S/c1-13-8-9-23(16-6-4-5-7-19(16)27-13)20(24)12-22-15-11-17(25-2)14(21)10-18(15)26-3/h4-7,10-11,13,22H,8-9,12H2,1-3H3