phenyl 2-[(4-azanylcyclohexyl)carbamoyl]-3-(3,4-dichlorophenyl)sulfonyl-imidazolidine-1-carboxylate

Systemtic Name: phenyl 2-[(4-azanylcyclohexyl)carbamoyl]-3-(3,4-dichlorophenyl)sulfonyl-imidazolidine-1-carboxylate Openeye Name: phenyl 2-[(4-aminocyclohexyl)carbamoyl]-3-(3,4-dichlorophenyl)sulfonyl-imidazolidine-1-carboxylate CAS Name: 2-[[(4-aminocyclohexyl)amino]-oxomethyl]-3-(3,4-dichlorophenyl)sulfonyl-1-imidazolidinecarboxylic acid phenyl ester IUPAC Name: phenyl 2-[(4-aminocyclohexyl)carbamoyl]-3-(3,4-dichlorophenyl)sulfonylimidazolidine-1-carboxylate Traditional Name: 2-[(4-aminocyclohexyl)carbamoyl]-3-(3,4-dichlorophenyl)sulfonyl-imidazolidine-1-carboxylic acid phenyl ester Formula: C23H26Cl2N4O5S MolecularWeight: 541.44734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2N(CCN2S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl)C(=O)OC4=CC=CC=C4

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2N(CCN2S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C23H26Cl2N4O5S/c24-19-11-10-18(14-20(19)25)35(32,33)29-13-12-28(23(31)34-17-4-2-1-3-5-17)22(29)21(30)27-16-8-6-15(26)7-9-16/h1-5,10-11,14-16,22H,6-9,12-13,26H2,(H,27,30)