4-(aminocarbonylamino)-N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-butanamide

Systemtic Name: 4-(aminocarbonylamino)-N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-butanamide Openeye Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-4-ureido-butanamide CAS Name: 4-(carbamoylamino)-N-[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl]-N-methylbutanamide IUPAC Name: 4-(carbamoylamino)-N-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl]-N-methylbutanamide Traditional Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-4-ureido-butyramide Formula: C22H24ClN5O2 MolecularWeight: 425.91126

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3)C(=O)CCCNC(=O)N

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3)C(=O)CCCNC(=O)N

InChI

InChI=1S/C22H24ClN5O2/c1-27(20(29)8-5-13-25-22(24)30)14-17-15-28(19-6-3-2-4-7-19)26-21(17)16-9-11-18(23)12-10-16/h2-4,6-7,9-12,15H,5,8,13-14H2,1H3,(H3,24,25,30)