N2-(2-azanylethyl)-N1-(3-methylphenyl)-3-(oxolan-2-ylcarbonyl)-1,3-diazinane-1,2-dicarboxamide

Systemtic Name: N2-(2-azanylethyl)-N1-(3-methylphenyl)-3-(oxolan-2-ylcarbonyl)-1,3-diazinane-1,2-dicarboxamide Openeye Name: N2-(2-aminoethyl)-N1-(m-tolyl)-3-(tetrahydrofuran-2-carbonyl)hexahydropyrimidine-1,2-dicarboxamide CAS Name: N2-(2-aminoethyl)-N1-(3-methylphenyl)-3-[oxo(2-oxolanyl)methyl]-1,3-diazinane-1,2-dicarboxamide IUPAC Name: 2-N-(2-aminoethyl)-1-N-(3-methylphenyl)-3-(oxolane-2-carbonyl)-1,3-diazinane-1,2-dicarboxamide Traditional Name: N'-(2-aminoethyl)-N-(m-tolyl)-3-(tetrahydrofuran-2-carbonyl)hexahydropyrimidine-1,2-dicarboxamide Formula: C20H29N5O4 MolecularWeight: 403.47536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCCN(C2C(=O)NCCN)C(=O)C3CCCO3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCCN(C2C(=O)NCCN)C(=O)C3CCCO3

InChI

InChI=1S/C20H29N5O4/c1-14-5-2-6-15(13-14)23-20(28)25-11-4-10-24(18(25)17(26)22-9-8-21)19(27)16-7-3-12-29-16/h2,5-6,13,16,18H,3-4,7-12,21H2,1H3,(H,22,26)(H,23,28)