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

Systemtic Name: N2-(4-azanylcyclohexyl)-N1-(3-bromophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(4-aminocyclohexyl)-N1-(3-bromophenyl)-3-(4-fluorophenyl)sulfonyl-hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-N1-(3-bromophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-1-N-(3-bromophenyl)-3-(4-fluorophenyl)sulfonyl-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(4-aminocyclohexyl)-N-(3-bromophenyl)-3-(4-fluorophenyl)sulfonyl-hexahydropyrimidine-1,2-dicarboxamide Formula: C24H29BrFN5O4S MolecularWeight: 582.485563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC3CCC(CC3)N)C(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(C(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC3CCC(CC3)N)C(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C24H29BrFN5O4S/c25-16-3-1-4-20(15-16)29-24(33)30-13-2-14-31(36(34,35)21-11-5-17(26)6-12-21)23(30)22(32)28-19-9-7-18(27)8-10-19/h1,3-6,11-12,15,18-19,23H,2,7-10,13-14,27H2,(H,28,32)(H,29,33)