N-[(4-methoxyphenyl)methyl]-2-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-2-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-[(4-methoxyphenyl)methyl]-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]-4-methylsulfanyl-butanamide CAS Name: N-[(4-methoxyphenyl)methyl]-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-2-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: 2-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonylamino]-4-(methylthio)-N-p-anisyl-butyramide Formula: C21H25N3O6S2 MolecularWeight: 479.5697

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)NC(CCSC)C(=O)NCC3=CC=C(C=C3)OC)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)NC(CCSC)C(=O)NCC3=CC=C(C=C3)OC)OC1=O

InChI

InChI=1S/C21H25N3O6S2/c1-24-18-9-8-16(12-19(18)30-21(24)26)32(27,28)23-17(10-11-31-3)20(25)22-13-14-4-6-15(29-2)7-5-14/h4-9,12,17,23H,10-11,13H2,1-3H3,(H,22,25)