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

Systemtic Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfanyl-butanamide CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-N-(6-methyl-1,3-benzothiazol-2-yl)-4-(methylthio)butanamide IUPAC Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-N-(6-methyl-1,3-benzothiazol-2-yl)-4-methylsulfanylbutanamide Traditional Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-N-(6-methyl-1,3-benzothiazol-2-yl)-4-(methylthio)butyramide Formula: C19H20FN3O3S3 MolecularWeight: 453.573803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(CCSC)NS(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)[C@H](CCSC)NS(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C19H20FN3O3S3/c1-12-7-8-14-16(11-12)28-19(21-14)22-18(24)15(9-10-27-2)23-29(25,26)17-6-4-3-5-13(17)20/h3-8,11,15,23H,9-10H2,1-2H3,(H,21,22,24)/t15-/m0/s1