5-(2-dimethylaminoethyl)-8-methoxy-2-(4-methylphenyl)-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 5-(2-dimethylaminoethyl)-8-methoxy-2-(4-methylphenyl)-3-oxidanyl-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 5-(2-dimethylaminoethyl)-3-hydroxy-8-methoxy-2-(p-tolyl)-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 5-(2-dimethylaminoethyl)-3-hydroxy-8-methoxy-2-(4-methylphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 5-(2-dimethylaminoethyl)-3-hydroxy-8-methoxy-2-(4-methylphenyl)-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 5-(2-dimethylaminoethyl)-3-hydroxy-8-methoxy-2-(p-tolyl)-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(=O)N(C3=C(S2)C=C(C=C3)OC)CCN(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)C2C(C(=O)N(C3=C(S2)C=C(C=C3)OC)CCN(C)C)O

InChI

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