(2S)-2-methyl-6-[[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]carbonyl]-4H-1,4-benzothiazin-3-one

Systemtic Name: (2S)-2-methyl-6-[[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]carbonyl]-4H-1,4-benzothiazin-3-one Openeye Name: (2S)-2-methyl-6-[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl]-4H-1,4-benzothiazin-3-one CAS Name: (2S)-2-methyl-6-[[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-oxomethyl]-4H-1,4-benzothiazin-3-one IUPAC Name: (2S)-2-methyl-6-[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl]-4H-1,4-benzothiazin-3-one Traditional Name: (2S)-2-methyl-6-[(2R)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl]-4H-1,4-benzothiazin-3-one Formula: C20H20N2O2S2 MolecularWeight: 384.515

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)C3=CC4=C(C=C3)SC(C(=O)N4)C

Isomeric SMILES

C[C@@H]1CCN(C2=CC=CC=C2S1)C(=O)C3=CC4=C(C=C3)S[C@H](C(=O)N4)C

InChI

InChI=1S/C20H20N2O2S2/c1-12-9-10-22(16-5-3-4-6-18(16)25-12)20(24)14-7-8-17-15(11-14)21-19(23)13(2)26-17/h3-8,11-13H,9-10H2,1-2H3,(H,21,23)/t12-,13+/m1/s1