cyclohexyl 4-[[4-methyl-6-oxidanylidene-1,5-bis(phenylmethyl)-1,3-diazinan-2-yl]amino]benzoate

Systemtic Name: cyclohexyl 4-[[4-methyl-6-oxidanylidene-1,5-bis(phenylmethyl)-1,3-diazinan-2-yl]amino]benzoate Openeye Name: cyclohexyl 4-[(1,5-dibenzyl-4-methyl-6-oxo-hexahydropyrimidin-2-yl)amino]benzoate CAS Name: 4-[[4-methyl-6-oxo-1,5-bis(phenylmethyl)-1,3-diazinan-2-yl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[(1,5-dibenzyl-4-methyl-6-oxo-1,3-diazinan-2-yl)amino]benzoate Traditional Name: 4-[(1,5-dibenzyl-6-keto-4-methyl-hexahydropyrimidin-2-yl)amino]benzoic acid cyclohexyl ester Formula: C32H37N3O3 MolecularWeight: 511.65448

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)N(C(N1)NC2=CC=C(C=C2)C(=O)OC3CCCCC3)CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CC1C(C(=O)N(C(N1)NC2=CC=C(C=C2)C(=O)OC3CCCCC3)CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C32H37N3O3/c1-23-29(21-24-11-5-2-6-12-24)30(36)35(22-25-13-7-3-8-14-25)32(33-23)34-27-19-17-26(18-20-27)31(37)38-28-15-9-4-10-16-28/h2-3,5-8,11-14,17-20,23,28-29,32-34H,4,9-10,15-16,21-22H2,1H3