N2-(2-azanylethyl)-N1-(3-methoxyphenyl)-3-(4-methylphenyl)carbonyl-1,3-diazinane-1,2-dicarboxamide

Systemtic Name: N2-(2-azanylethyl)-N1-(3-methoxyphenyl)-3-(4-methylphenyl)carbonyl-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(2-aminoethyl)-N1-(3-methoxyphenyl)-3-(4-methylbenzoyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(2-aminoethyl)-N1-(3-methoxyphenyl)-3-[(4-methylphenyl)-oxomethyl]-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(2-aminoethyl)-1-N-(3-methoxyphenyl)-3-(4-methylbenzoyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(2-aminoethyl)-N-(3-methoxyphenyl)-3-p-toluoyl-hexahydropyrimidine-1,2-dicarboxamide Formula: C23H29N5O4 MolecularWeight: 439.50746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCN(C2C(=O)NCCN)C(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCN(C2C(=O)NCCN)C(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C23H29N5O4/c1-16-7-9-17(10-8-16)22(30)27-13-4-14-28(21(27)20(29)25-12-11-24)23(31)26-18-5-3-6-19(15-18)32-2/h3,5-10,15,21H,4,11-14,24H2,1-2H3,(H,25,29)(H,26,31)