8-chloranyl-5-(2-dimethylaminoethyl)-2-(4-methylphenyl)-1,5-benzothiazepine-3,4-dione

Systemtic Name: 8-chloranyl-5-(2-dimethylaminoethyl)-2-(4-methylphenyl)-1,5-benzothiazepine-3,4-dione Openeye Name: 8-chloro-5-(2-dimethylaminoethyl)-2-(p-tolyl)-1,5-benzothiazepine-3,4-dione CAS Name: 8-chloro-5-(2-dimethylaminoethyl)-2-(4-methylphenyl)-1,5-benzothiazepine-3,4-dione IUPAC Name: 8-chloro-5-(2-dimethylaminoethyl)-2-(4-methylphenyl)-1,5-benzothiazepine-3,4-dione Traditional Name: 8-chloro-5-(2-dimethylaminoethyl)-2-(p-tolyl)-1,5-benzothiazepine-3,4-quinone Formula: C20H21ClN2O2S MolecularWeight: 388.91094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=O)C(=O)N(C3=C(S2)C=C(C=C3)Cl)CCN(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2C(=O)C(=O)N(C3=C(S2)C=C(C=C3)Cl)CCN(C)C

InChI

InChI=1S/C20H21ClN2O2S/c1-13-4-6-14(7-5-13)19-18(24)20(25)23(11-10-22(2)3)16-9-8-15(21)12-17(16)26-19/h4-9,12,19H,10-11H2,1-3H3