N2-(4-azanylcyclohexyl)-3-(5-chloranylthiophen-2-yl)sulfonyl-N1-(4-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide

Systemtic Name: N2-(4-azanylcyclohexyl)-3-(5-chloranylthiophen-2-yl)sulfonyl-N1-(4-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(4-aminocyclohexyl)-3-[(5-chloro-2-thienyl)sulfonyl]-N1-(4-methoxyphenyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-3-[(5-chloro-2-thiophenyl)sulfonyl]-N1-(4-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-3-(5-chlorothiophen-2-yl)sulfonyl-1-N-(4-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(4-aminocyclohexyl)-3-[(5-chloro-2-thienyl)sulfonyl]-N-(4-methoxyphenyl)hexahydropyrimidine-1,2-dicarboxamide Formula: C23H30ClN5O5S2 MolecularWeight: 556.0978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C23H30ClN5O5S2/c1-34-18-9-7-17(8-10-18)27-23(31)28-13-2-14-29(36(32,33)20-12-11-19(24)35-20)22(28)21(30)26-16-5-3-15(25)4-6-16/h7-12,15-16,22H,2-6,13-14,25H2,1H3,(H,26,30)(H,27,31)