(2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)-4-methylsulfanyl-butanamide CAS Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(methylthio)butanamide IUPAC Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)-4-methylsulfanylbutanamide Traditional Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(methylthio)butyramide Formula: C19H20ClN3O4S3 MolecularWeight: 486.0278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C(CCSC)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)[C@H](CCSC)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H20ClN3O4S3/c1-27-13-5-8-15-17(11-13)29-19(21-15)22-18(24)16(9-10-28-2)23-30(25,26)14-6-3-12(20)4-7-14/h3-8,11,16,23H,9-10H2,1-2H3,(H,21,22,24)/t16-/m0/s1