N2-(4-azanylcyclohexyl)-3-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonyl-N1-(4-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide

Systemtic Name: N2-(4-azanylcyclohexyl)-3-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonyl-N1-(4-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(4-aminocyclohexyl)-3-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-N1-(4-methoxyphenyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-3-[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]-N1-(4-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-3-(5-tert-butyl-2-methylpyrazole-3-carbonyl)-1-N-(4-methoxyphenyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(4-aminocyclohexyl)-3-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-N-(4-methoxyphenyl)hexahydropyrimidine-1,2-dicarboxamide Formula: C28H41N7O4 MolecularWeight: 539.66964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)NC4=CC=C(C=C4)OC)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)NC4=CC=C(C=C4)OC)C

InChI

InChI=1S/C28H41N7O4/c1-28(2,3)23-17-22(33(4)32-23)26(37)34-15-6-16-35(27(38)31-20-11-13-21(39-5)14-12-20)25(34)24(36)30-19-9-7-18(29)8-10-19/h11-14,17-19,25H,6-10,15-16,29H2,1-5H3,(H,30,36)(H,31,38)