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

Systemtic Name: N2-(4-azanylcyclohexyl)-3-(4-fluorophenyl)sulfonyl-N1-(4-propan-2-ylphenyl)-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(4-aminocyclohexyl)-3-(4-fluorophenyl)sulfonyl-N1-(4-isopropylphenyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-3-(4-fluorophenyl)sulfonyl-N1-(4-propan-2-ylphenyl)-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-3-(4-fluorophenyl)sulfonyl-1-N-(4-propan-2-ylphenyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(4-aminocyclohexyl)-3-(4-fluorophenyl)sulfonyl-N-p-cumenyl-hexahydropyrimidine-1,2-dicarboxamide Formula: C27H36FN5O4S MolecularWeight: 545.669243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H36FN5O4S/c1-18(2)19-4-10-23(11-5-19)31-27(35)32-16-3-17-33(38(36,37)24-14-6-20(28)7-15-24)26(32)25(34)30-22-12-8-21(29)9-13-22/h4-7,10-11,14-15,18,21-22,26H,3,8-9,12-13,16-17,29H2,1-2H3,(H,30,34)(H,31,35)