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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24Cl2N4O3/c1-14-4-2-5-15(12-14)21(30)27-10-3-11-28(20(27)19(29)26-9-8-25)22(31)17-7-6-16(23)13-18(17)24/h2,4-7,12-13,20H,3,8-11,25H2,1H3,(H,26,29)