5-[1-(dimethylamino)propan-2-yl]-2-(4-methoxyphenyl)-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 5-[1-(dimethylamino)propan-2-yl]-2-(4-methoxyphenyl)-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 5-[2-(dimethylamino)-1-methyl-ethyl]-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 5-[1-(dimethylamino)propan-2-yl]-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 5-[1-(dimethylamino)propan-2-yl]-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 5-[2-(dimethylamino)-1-methyl-ethyl]-3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C)C)N1C2=CC=CC=C2SC(C(C1=O)O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(CN(C)C)N1C2=CC=CC=C2SC(C(C1=O)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N2O3S/c1-14(13-22(2)3)23-17-7-5-6-8-18(17)27-20(19(24)21(23)25)15-9-11-16(26-4)12-10-15/h5-12,14,19-20,24H,13H2,1-4H3