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

Systemtic Name: N2-(2-azanylethyl)-3-(4-methylphenyl)carbonyl-N1-(4-propan-2-ylphenyl)-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(2-aminoethyl)-N1-(4-isopropylphenyl)-3-(4-methylbenzoyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(2-aminoethyl)-3-[(4-methylphenyl)-oxomethyl]-N1-(4-propan-2-ylphenyl)-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(2-aminoethyl)-3-(4-methylbenzoyl)-1-N-(4-propan-2-ylphenyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(2-aminoethyl)-N-p-cumenyl-3-p-toluoyl-hexahydropyrimidine-1,2-dicarboxamide Formula: C25H33N5O3 MolecularWeight: 451.56122

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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=C(C=C3)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H33N5O3/c1-17(2)19-9-11-21(12-10-19)28-25(33)30-16-4-15-29(23(30)22(31)27-14-13-26)24(32)20-7-5-18(3)6-8-20/h5-12,17,23H,4,13-16,26H2,1-3H3,(H,27,31)(H,28,33)