N-[4-[(4-azanylcyclohexyl)carbamoyl]-2-methyl-phenyl]-1-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxamide

Systemtic Name: N-[4-[(4-azanylcyclohexyl)carbamoyl]-2-methyl-phenyl]-1-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxamide Openeye Name: N-[4-[(4-aminocyclohexyl)carbamoyl]-2-methyl-phenyl]-1-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxamide CAS Name: N-[4-[[(4-aminocyclohexyl)amino]-oxomethyl]-2-methylphenyl]-1-(4-chlorophenyl)-5-propyl-4-pyrazolecarboxamide IUPAC Name: N-[4-[(4-aminocyclohexyl)carbamoyl]-2-methylphenyl]-1-(4-chlorophenyl)-5-propylpyrazole-4-carboxamide Traditional Name: N-[4-[(4-aminocyclohexyl)carbamoyl]-2-methyl-phenyl]-1-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxamide Formula: C27H32ClN5O2 MolecularWeight: 494.02828

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)NC3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)C

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)NC3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)C

InChI

InChI=1S/C27H32ClN5O2/c1-3-4-25-23(16-30-33(25)22-12-6-19(28)7-13-22)27(35)32-24-14-5-18(15-17(24)2)26(34)31-21-10-8-20(29)9-11-21/h5-7,12-16,20-21H,3-4,8-11,29H2,1-2H3,(H,31,34)(H,32,35)