N-methyl-3-[[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]carbonyl]-N-propan-2-yl-benzenesulfonamide

Systemtic Name: N-methyl-3-[[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]carbonyl]-N-propan-2-yl-benzenesulfonamide Openeye Name: N-isopropyl-N-methyl-3-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl]benzenesulfonamide CAS Name: N-methyl-3-[[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-oxomethyl]-N-propan-2-ylbenzenesulfonamide IUPAC Name: N-methyl-3-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl]-N-propan-2-ylbenzenesulfonamide Traditional Name: N-isopropyl-N-methyl-3-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbonyl]benzenesulfonamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)C3=CC(=CC=C3)S(=O)(=O)N(C)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3S2/c1-15(2)22(4)28(25,26)18-9-7-8-17(14-18)21(24)23-13-12-16(3)27-20-11-6-5-10-19(20)23/h5-11,14-16H,12-13H2,1-4H3/t16-/m0/s1