2-(2,4-dichlorophenyl)-5-(2-dimethylaminoethyl)-1,5-benzothiazepine-3,4-dione

Systemtic Name: 2-(2,4-dichlorophenyl)-5-(2-dimethylaminoethyl)-1,5-benzothiazepine-3,4-dione Openeye Name: 2-(2,4-dichlorophenyl)-5-(2-dimethylaminoethyl)-1,5-benzothiazepine-3,4-dione CAS Name: 2-(2,4-dichlorophenyl)-5-(2-dimethylaminoethyl)-1,5-benzothiazepine-3,4-dione IUPAC Name: 2-(2,4-dichlorophenyl)-5-(2-dimethylaminoethyl)-1,5-benzothiazepine-3,4-dione Traditional Name: 2-(2,4-dichlorophenyl)-5-(2-dimethylaminoethyl)-1,5-benzothiazepine-3,4-quinone Formula: C19H18Cl2N2O2S MolecularWeight: 409.32942

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C2=CC=CC=C2SC(C(=O)C1=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CN(C)CCN1C2=CC=CC=C2SC(C(=O)C1=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H18Cl2N2O2S/c1-22(2)9-10-23-15-5-3-4-6-16(15)26-18(17(24)19(23)25)13-8-7-12(20)11-14(13)21/h3-8,11,18H,9-10H2,1-2H3