2-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-2-phenyl-3-propoxy-4-(1,4,5,6-tetrahydropyrimidin-2-ylamino)butanoic acid

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-2-phenyl-3-propoxy-4-(1,4,5,6-tetrahydropyrimidin-2-ylamino)butanoic acid Openeye Name: 4-oxo-2-phenyl-3-propoxy-2-(p-tolylsulfonylamino)-4-(1,4,5,6-tetrahydropyrimidin-2-ylamino)butanoic acid CAS Name: 2-[(4-methylphenyl)sulfonylamino]-4-oxo-2-phenyl-3-propoxy-4-(1,4,5,6-tetrahydropyrimidin-2-ylamino)butanoic acid IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-4-oxo-2-phenyl-3-propoxy-4-(1,4,5,6-tetrahydropyrimidin-2-ylamino)butanoic acid Traditional Name: 4-keto-2-phenyl-3-propoxy-4-(1,4,5,6-tetrahydropyrimidin-2-ylamino)-2-(tosylamino)butyric acid Formula: C24H30N4O6S MolecularWeight: 502.5832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C(=O)NC1=NCCCN1)C(C2=CC=CC=C2)(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCOC(C(=O)NC1=NCCCN1)C(C2=CC=CC=C2)(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H30N4O6S/c1-3-16-34-20(21(29)27-23-25-14-7-15-26-23)24(22(30)31,18-8-5-4-6-9-18)28-35(32,33)19-12-10-17(2)11-13-19/h4-6,8-13,20,28H,3,7,14-16H2,1-2H3,(H,30,31)(H2,25,26,27,29)