phenyl 2-[(4-azanylcyclohexyl)carbamoyl]-3-(3-methylphenyl)carbonyl-imidazolidine-1-carboxylate

Systemtic Name: phenyl 2-[(4-azanylcyclohexyl)carbamoyl]-3-(3-methylphenyl)carbonyl-imidazolidine-1-carboxylate Openeye Name: phenyl 2-[(4-aminocyclohexyl)carbamoyl]-3-(3-methylbenzoyl)imidazolidine-1-carboxylate CAS Name: 2-[[(4-aminocyclohexyl)amino]-oxomethyl]-3-[(3-methylphenyl)-oxomethyl]-1-imidazolidinecarboxylic acid phenyl ester IUPAC Name: phenyl 2-[(4-aminocyclohexyl)carbamoyl]-3-(3-methylbenzoyl)imidazolidine-1-carboxylate Traditional Name: 2-[(4-aminocyclohexyl)carbamoyl]-3-m-toluoyl-imidazolidine-1-carboxylic acid phenyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)C(=O)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C25H30N4O4/c1-17-6-5-7-18(16-17)24(31)28-14-15-29(25(32)33-21-8-3-2-4-9-21)23(28)22(30)27-20-12-10-19(26)11-13-20/h2-9,16,19-20,23H,10-15,26H2,1H3,(H,27,30)