N-(6-methoxypyridin-3-yl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-(6-methoxypyridin-3-yl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-(6-methoxy-3-pyridyl)-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-(6-methoxy-3-pyridinyl)-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-(6-methoxypyridin-3-yl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-(6-methoxy-3-pyridyl)-4-(methylthio)-2-(tosylamino)butyramide Formula: C18H23N3O4S2 MolecularWeight: 409.52292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2=CN=C(C=C2)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2=CN=C(C=C2)OC

InChI

InChI=1S/C18H23N3O4S2/c1-13-4-7-15(8-5-13)27(23,24)21-16(10-11-26-3)18(22)20-14-6-9-17(25-2)19-12-14/h4-9,12,16,21H,10-11H2,1-3H3,(H,20,22)