N2-(4-azanylcyclohexyl)-3-(4-fluorophenyl)sulfonyl-N1-(4-methylphenyl)-1,3-diazinane-1,2-dicarboxamide

Systemtic Name: N2-(4-azanylcyclohexyl)-3-(4-fluorophenyl)sulfonyl-N1-(4-methylphenyl)-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(4-aminocyclohexyl)-3-(4-fluorophenyl)sulfonyl-N1-(p-tolyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-3-(4-fluorophenyl)sulfonyl-N1-(4-methylphenyl)-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-3-(4-fluorophenyl)sulfonyl-1-N-(4-methylphenyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(4-aminocyclohexyl)-3-(4-fluorophenyl)sulfonyl-N-(p-tolyl)hexahydropyrimidine-1,2-dicarboxamide Formula: C25H32FN5O4S MolecularWeight: 517.616083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H32FN5O4S/c1-17-3-9-21(10-4-17)29-25(33)30-15-2-16-31(36(34,35)22-13-5-18(26)6-14-22)24(30)23(32)28-20-11-7-19(27)8-12-20/h3-6,9-10,13-14,19-20,24H,2,7-8,11-12,15-16,27H2,1H3,(H,28,32)(H,29,33)