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

Systemtic Name: N-(4-azanylcyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-methylsulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-methylsulfonyl-hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-methylsulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-methylsulfonyl-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(3,4-dichlorophenyl)sulfonyl-3-mesyl-hexahydropyrimidine-2-carboxamide Formula: C18H26Cl2N4O5S2 MolecularWeight: 513.45884

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(C1C(=O)NC2CCC(CC2)N)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CS(=O)(=O)N1CCCN(C1C(=O)NC2CCC(CC2)N)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H26Cl2N4O5S2/c1-30(26,27)23-9-2-10-24(31(28,29)14-7-8-15(19)16(20)11-14)18(23)17(25)22-13-5-3-12(21)4-6-13/h7-8,11-13,18H,2-6,9-10,21H2,1H3,(H,22,25)