2-[2-(3,4-dimethoxyphenyl)-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl]ethanamide

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl]ethanamide Openeye Name: 2-[2-(3,4-dimethoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide CAS Name: 2-[2-(3,4-dimethoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide Traditional Name: 2-[2-(3,4-dimethoxyphenyl)-4-keto-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=O)N(C3=CC=CC=C3S2)CC(=O)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=O)N(C3=CC=CC=C3S2)CC(=O)N)OC

InChI

InChI=1S/C19H20N2O4S/c1-24-14-8-7-12(9-15(14)25-2)17-10-19(23)21(11-18(20)22)13-5-3-4-6-16(13)26-17/h3-9,17H,10-11H2,1-2H3,(H2,20,22)