N-[4-[3-[(3-methylphenyl)methyl]-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]-2-phenyl-butanamide

Systemtic Name: N-[4-[3-[(3-methylphenyl)methyl]-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]-2-phenyl-butanamide Openeye Name: N-[4-[3-(m-tolylmethyl)-2-oxo-hexahydropyrimidin-1-yl]phenyl]-2-phenyl-butanamide CAS Name: N-[4-[3-[(3-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-2-phenylbutanamide IUPAC Name: N-[4-[3-[(3-methylphenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-2-phenylbutanamide Traditional Name: N-[4-[2-keto-3-(3-methylbenzyl)hexahydropyrimidin-1-yl]phenyl]-2-phenyl-butyramide Formula: C28H31N3O2 MolecularWeight: 441.56464

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)N3CCCN(C3=O)CC4=CC=CC(=C4)C

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)N3CCCN(C3=O)CC4=CC=CC(=C4)C

InChI

InChI=1S/C28H31N3O2/c1-3-26(23-11-5-4-6-12-23)27(32)29-24-13-15-25(16-14-24)31-18-8-17-30(28(31)33)20-22-10-7-9-21(2)19-22/h4-7,9-16,19,26H,3,8,17-18,20H2,1-2H3,(H,29,32)