(2S)-2-(3,4-dimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: (2S)-2-(3,4-dimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: (2S)-2-(3,4-dimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: (2S)-2-(3,4-dimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: (2S)-2-(3,4-dimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: (2S)-2-(3,4-dimethoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=O)NC3=CC=CC=C3S2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]2CC(=O)NC3=CC=CC=C3S2)OC

InChI

InChI=1S/C17H17NO3S/c1-20-13-8-7-11(9-14(13)21-2)16-10-17(19)18-12-5-3-4-6-15(12)22-16/h3-9,16H,10H2,1-2H3,(H,18,19)/t16-/m0/s1