N-(4-azanylcyclohexyl)-1-[2-(4-chloranylphenoxy)ethanoyl]-3-(3-methylphenyl)carbonyl-imidazolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-[2-(4-chloranylphenoxy)ethanoyl]-3-(3-methylphenyl)carbonyl-imidazolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-[2-(4-chlorophenoxy)acetyl]-3-(3-methylbenzoyl)imidazolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[2-(4-chlorophenoxy)-1-oxoethyl]-3-[(3-methylphenyl)-oxomethyl]-2-imidazolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-[2-(4-chlorophenoxy)acetyl]-3-(3-methylbenzoyl)imidazolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-[2-(4-chlorophenoxy)acetyl]-3-m-toluoyl-imidazolidine-2-carboxamide Formula: C26H31ClN4O4 MolecularWeight: 499.00174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)C(=O)COC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)C(=O)COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H31ClN4O4/c1-17-3-2-4-18(15-17)26(34)31-14-13-30(23(32)16-35-22-11-5-19(27)6-12-22)25(31)24(33)29-21-9-7-20(28)8-10-21/h2-6,11-12,15,20-21,25H,7-10,13-14,16,28H2,1H3,(H,29,33)