N-(4-azanylcyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-pyridin-4-ylcarbonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-pyridin-4-ylcarbonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-(pyridine-4-carbonyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-[oxo(pyridin-4-yl)methyl]-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-(pyridine-4-carbonyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-isonicotinoyl-hexahydropyrimidine-2-carboxamide Formula: C23H27Cl2N5O4S MolecularWeight: 540.46258

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)NC3CCC(CC3)N)C(=O)C4=CC=NC=C4

Isomeric SMILES

C1CN(C(N(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)NC3CCC(CC3)N)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C23H27Cl2N5O4S/c24-19-7-6-18(14-20(19)25)35(33,34)30-13-1-12-29(23(32)15-8-10-27-11-9-15)22(30)21(31)28-17-4-2-16(26)3-5-17/h6-11,14,16-17,22H,1-5,12-13,26H2,(H,28,31)