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

Systemtic Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide CAS Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)butyramide Formula: C20H23N3O4S2 MolecularWeight: 433.54432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O4S2/c1-12(2)18(23-29(25,26)15-8-6-14(27-4)7-9-15)19(24)22-20-21-16-10-5-13(3)11-17(16)28-20/h5-12,18,23H,1-4H3,(H,21,22,24)/t18-/m0/s1