2-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: 2-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: 2-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: 2-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: 2-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: 2-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1C(C(=O)NC2=CC=CC=C2S1)C3=CC=C(C=C3)OC

Isomeric SMILES

CN(C)CCC1C(C(=O)NC2=CC=CC=C2S1)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H24N2O2S/c1-22(2)13-12-18-19(14-8-10-15(24-3)11-9-14)20(23)21-16-6-4-5-7-17(16)25-18/h4-11,18-19H,12-13H2,1-3H3,(H,21,23)