7-chloranyl-2-(4-chlorophenyl)-5-(2-dimethylaminoethyl)-1,5-benzothiazepine-3,4-dione

Systemtic Name: 7-chloranyl-2-(4-chlorophenyl)-5-(2-dimethylaminoethyl)-1,5-benzothiazepine-3,4-dione Openeye Name: 7-chloro-2-(4-chlorophenyl)-5-(2-dimethylaminoethyl)-1,5-benzothiazepine-3,4-dione CAS Name: 7-chloro-2-(4-chlorophenyl)-5-(2-dimethylaminoethyl)-1,5-benzothiazepine-3,4-dione IUPAC Name: 7-chloro-2-(4-chlorophenyl)-5-(2-dimethylaminoethyl)-1,5-benzothiazepine-3,4-dione Traditional Name: 7-chloro-2-(4-chlorophenyl)-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=C(C=CC(=C2)Cl)SC(C(=O)C1=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C)CCN1C2=C(C=CC(=C2)Cl)SC(C(=O)C1=O)C3=CC=C(C=C3)Cl

InChI

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