N-(4-azanylcyclohexyl)-1-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonyl-3-(3-fluorophenyl)carbonyl-imidazolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonyl-3-(3-fluorophenyl)carbonyl-imidazolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonyl-3-(3-fluorobenzoyl)imidazolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonyl]-3-[(3-fluorophenyl)-oxomethyl]-2-imidazolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonyl-3-(3-fluorobenzoyl)imidazolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonyl-3-(3-fluorobenzoyl)imidazolidine-2-carboxamide Formula: C22H28ClFN6O4S MolecularWeight: 527.011923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4=CC(=CC=C4)F)Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)N2CCN(C2C(=O)NC3CCC(CC3)N)C(=O)C4=CC(=CC=C4)F)Cl)C

InChI

InChI=1S/C22H28ClFN6O4S/c1-13-18(19(23)28(2)27-13)35(33,34)30-11-10-29(22(32)14-4-3-5-15(24)12-14)21(30)20(31)26-17-8-6-16(25)7-9-17/h3-5,12,16-17,21H,6-11,25H2,1-2H3,(H,26,31)