(2S,3S)-2-(4-methoxyphenyl)-3-oxidanyl-8-propan-2-yl-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: (2S,3S)-2-(4-methoxyphenyl)-3-oxidanyl-8-propan-2-yl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: (2S,3S)-3-hydroxy-8-isopropyl-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: (2S,3S)-3-hydroxy-2-(4-methoxyphenyl)-8-propan-2-yl-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: (2S,3S)-3-hydroxy-2-(4-methoxyphenyl)-8-propan-2-yl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: (2S,3S)-3-hydroxy-8-isopropyl-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)NC(=O)C(C(S2)C3=CC=C(C=C3)OC)O

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)NC(=O)[C@@H]([C@@H](S2)C3=CC=C(C=C3)OC)O

InChI

InChI=1S/C19H21NO3S/c1-11(2)13-6-9-15-16(10-13)24-18(17(21)19(22)20-15)12-4-7-14(23-3)8-5-12/h4-11,17-18,21H,1-3H3,(H,20,22)/t17-,18+/m1/s1