N-(4-azanylcyclohexyl)-1-cyclohexylcarbonyl-3-(4-methylphenyl)carbonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-cyclohexylcarbonyl-3-(4-methylphenyl)carbonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(cyclohexanecarbonyl)-3-(4-methylbenzoyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[cyclohexyl(oxo)methyl]-3-[(4-methylphenyl)-oxomethyl]-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(cyclohexanecarbonyl)-3-(4-methylbenzoyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(cyclohexanecarbonyl)-3-p-toluoyl-hexahydropyrimidine-2-carboxamide Formula: C26H38N4O3 MolecularWeight: 454.60492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4CCCCC4

InChI

InChI=1S/C26H38N4O3/c1-18-8-10-20(11-9-18)26(33)30-17-5-16-29(25(32)19-6-3-2-4-7-19)24(30)23(31)28-22-14-12-21(27)13-15-22/h8-11,19,21-22,24H,2-7,12-17,27H2,1H3,(H,28,31)