phenyl 2-[[3-(aminomethyl)phenyl]methylcarbamoyl]-3-[(3-methylphenyl)carbamoyl]imidazolidine-1-carboxylate

Systemtic Name: phenyl 2-[[3-(aminomethyl)phenyl]methylcarbamoyl]-3-[(3-methylphenyl)carbamoyl]imidazolidine-1-carboxylate Openeye Name: phenyl 2-[[3-(aminomethyl)phenyl]methylcarbamoyl]-3-(m-tolylcarbamoyl)imidazolidine-1-carboxylate CAS Name: 2-[[[3-(aminomethyl)phenyl]methylamino]-oxomethyl]-3-[(3-methylanilino)-oxomethyl]-1-imidazolidinecarboxylic acid phenyl ester IUPAC Name: phenyl 2-[[3-(aminomethyl)phenyl]methylcarbamoyl]-3-[(3-methylphenyl)carbamoyl]imidazolidine-1-carboxylate Traditional Name: 2-[[3-(aminomethyl)benzyl]carbamoyl]-3-(m-tolylcarbamoyl)imidazolidine-1-carboxylic acid phenyl ester Formula: C27H29N5O4 MolecularWeight: 487.55026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCN(C2C(=O)NCC3=CC=CC(=C3)CN)C(=O)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCN(C2C(=O)NCC3=CC=CC(=C3)CN)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C27H29N5O4/c1-19-7-5-10-22(15-19)30-26(34)31-13-14-32(27(35)36-23-11-3-2-4-12-23)25(31)24(33)29-18-21-9-6-8-20(16-21)17-28/h2-12,15-16,25H,13-14,17-18,28H2,1H3,(H,29,33)(H,30,34)