N-(2-azanylethyl)-1-(3-cyclopentylpropanoyl)-3-(3-methylphenyl)carbonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(3-cyclopentylpropanoyl)-3-(3-methylphenyl)carbonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(3-cyclopentylpropanoyl)-3-(3-methylbenzoyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-(3-cyclopentyl-1-oxopropyl)-3-[(3-methylphenyl)-oxomethyl]-1,3-diazinane-2-carboxamide IUPAC Name: N-(2-aminoethyl)-1-(3-cyclopentylpropanoyl)-3-(3-methylbenzoyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(3-cyclopentylpropanoyl)-3-m-toluoyl-hexahydropyrimidine-2-carboxamide Formula: C23H34N4O3 MolecularWeight: 414.54106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCCN(C2C(=O)NCCN)C(=O)CCC3CCCC3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCCN(C2C(=O)NCCN)C(=O)CCC3CCCC3

InChI

InChI=1S/C23H34N4O3/c1-17-6-4-9-19(16-17)23(30)27-15-5-14-26(22(27)21(29)25-13-12-24)20(28)11-10-18-7-2-3-8-18/h4,6,9,16,18,22H,2-3,5,7-8,10-15,24H2,1H3,(H,25,29)