N-(2-azanylethyl)-1-(2,4-dichlorophenyl)carbonyl-3-(4-methylphenyl)carbonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(2,4-dichlorophenyl)carbonyl-3-(4-methylphenyl)carbonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(2,4-dichlorobenzoyl)-3-(4-methylbenzoyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(2,4-dichlorophenyl)-oxomethyl]-3-[(4-methylphenyl)-oxomethyl]-1,3-diazinane-2-carboxamide IUPAC Name: N-(2-aminoethyl)-1-(2,4-dichlorobenzoyl)-3-(4-methylbenzoyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(2,4-dichlorobenzoyl)-3-p-toluoyl-hexahydropyrimidine-2-carboxamide Formula: C22H24Cl2N4O3 MolecularWeight: 463.35696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24Cl2N4O3/c1-14-3-5-15(6-4-14)21(30)27-11-2-12-28(20(27)19(29)26-10-9-25)22(31)17-8-7-16(23)13-18(17)24/h3-8,13,20H,2,9-12,25H2,1H3,(H,26,29)