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

Systemtic Name: phenyl 2-[(4-azanylcyclohexyl)carbamoyl]-3-(4-fluorophenyl)sulfonyl-imidazolidine-1-carboxylate Openeye Name: phenyl 2-[(4-aminocyclohexyl)carbamoyl]-3-(4-fluorophenyl)sulfonyl-imidazolidine-1-carboxylate CAS Name: 2-[[(4-aminocyclohexyl)amino]-oxomethyl]-3-(4-fluorophenyl)sulfonyl-1-imidazolidinecarboxylic acid phenyl ester IUPAC Name: phenyl 2-[(4-aminocyclohexyl)carbamoyl]-3-(4-fluorophenyl)sulfonylimidazolidine-1-carboxylate Traditional Name: 2-[(4-aminocyclohexyl)carbamoyl]-3-(4-fluorophenyl)sulfonyl-imidazolidine-1-carboxylic acid phenyl ester Formula: C23H27FN4O5S MolecularWeight: 490.547683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27FN4O5S/c24-16-6-12-20(13-7-16)34(31,32)28-15-14-27(23(30)33-19-4-2-1-3-5-19)22(28)21(29)26-18-10-8-17(25)9-11-18/h1-7,12-13,17-18,22H,8-11,14-15,25H2,(H,26,29)