7-chloranyl-5-[3-(dimethylamino)propyl]-3-oxidanyl-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 7-chloranyl-5-[3-(dimethylamino)propyl]-3-oxidanyl-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 7-chloro-5-[3-(dimethylamino)propyl]-3-hydroxy-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 7-chloro-5-[3-(dimethylamino)propyl]-3-hydroxy-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 7-chloro-5-[3-(dimethylamino)propyl]-3-hydroxy-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 7-chloro-5-[3-(dimethylamino)propyl]-3-hydroxy-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C20H23ClN2O2S MolecularWeight: 390.92682

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C2=C(C=CC(=C2)Cl)SC(C(C1=O)O)C3=CC=CC=C3

Isomeric SMILES

CN(C)CCCN1C2=C(C=CC(=C2)Cl)SC(C(C1=O)O)C3=CC=CC=C3

InChI

InChI=1S/C20H23ClN2O2S/c1-22(2)11-6-12-23-16-13-15(21)9-10-17(16)26-19(18(24)20(23)25)14-7-4-3-5-8-14/h3-5,7-10,13,18-19,24H,6,11-12H2,1-2H3