7-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]carbonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: 7-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]carbonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: 7-[4-(2,4-dichlorobenzoyl)piperazine-1-carbonyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: 7-[[4-[(2,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: 7-[4-(2,4-dichlorobenzoyl)piperazine-1-carbonyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: 7-[4-(2,4-dichlorobenzoyl)piperazine-1-carbonyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C21H19Cl2N3O3S MolecularWeight: 464.36486

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=C(C=C(C=C4)Cl)Cl)NC1=O

Isomeric SMILES

C1CSC2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=C(C=C(C=C4)Cl)Cl)NC1=O

InChI

InChI=1S/C21H19Cl2N3O3S/c22-14-2-3-15(16(23)12-14)21(29)26-8-6-25(7-9-26)20(28)13-1-4-18-17(11-13)24-19(27)5-10-30-18/h1-4,11-12H,5-10H2,(H,24,27)