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

Systemtic Name: 3-chloranyl-5-[3-(dimethylamino)propyl]-2-phenyl-1,5-benzothiazepin-4-one Openeye Name: 3-chloro-5-[3-(dimethylamino)propyl]-2-phenyl-1,5-benzothiazepin-4-one CAS Name: 3-chloro-5-[3-(dimethylamino)propyl]-2-phenyl-1,5-benzothiazepin-4-one IUPAC Name: 3-chloro-5-[3-(dimethylamino)propyl]-2-phenyl-1,5-benzothiazepin-4-one Traditional Name: 3-chloro-5-[3-(dimethylamino)propyl]-2-phenyl-1,5-benzothiazepin-4-one Formula: C20H21ClN2OS MolecularWeight: 372.91154

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C2=CC=CC=C2SC(=C(C1=O)Cl)C3=CC=CC=C3

Isomeric SMILES

CN(C)CCCN1C2=CC=CC=C2SC(=C(C1=O)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H21ClN2OS/c1-22(2)13-8-14-23-16-11-6-7-12-17(16)25-19(18(21)20(23)24)15-9-4-3-5-10-15/h3-7,9-12H,8,13-14H2,1-2H3