(2S)-2-(4-ethoxy-3-methoxy-phenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: (2S)-2-(4-ethoxy-3-methoxy-phenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: (2S)-2-(4-ethoxy-3-methoxy-phenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: (2S)-2-(4-ethoxy-3-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: (2S)-2-(4-ethoxy-3-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: (2S)-2-(4-ethoxy-3-methoxy-phenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2CC(=O)NC3=CC=CC=C3S2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@@H]2CC(=O)NC3=CC=CC=C3S2)OC

InChI

InChI=1S/C18H19NO3S/c1-3-22-14-9-8-12(10-15(14)21-2)17-11-18(20)19-13-6-4-5-7-16(13)23-17/h4-10,17H,3,11H2,1-2H3,(H,19,20)/t17-/m0/s1