N-(4-azanylcyclohexyl)-1-[2-(4-methoxyphenyl)ethanoyl]-3-(4-methylphenyl)carbonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-[2-(4-methoxyphenyl)ethanoyl]-3-(4-methylphenyl)carbonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-[2-(4-methoxyphenyl)acetyl]-3-(4-methylbenzoyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[2-(4-methoxyphenyl)-1-oxoethyl]-3-[(4-methylphenyl)-oxomethyl]-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-[2-(4-methoxyphenyl)acetyl]-3-(4-methylbenzoyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-[2-(4-methoxyphenyl)acetyl]-3-p-toluoyl-hexahydropyrimidine-2-carboxamide Formula: C28H36N4O4 MolecularWeight: 492.60984

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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)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)C(=O)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C28H36N4O4/c1-19-4-8-21(9-5-19)28(35)32-17-3-16-31(25(33)18-20-6-14-24(36-2)15-7-20)27(32)26(34)30-23-12-10-22(29)11-13-23/h4-9,14-15,22-23,27H,3,10-13,16-18,29H2,1-2H3,(H,30,34)