N-aminocarbonyl-3-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-amino]propanamide

Systemtic Name: N-aminocarbonyl-3-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-amino]propanamide Openeye Name: N-carbamoyl-3-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-amino]propanamide CAS Name: N-carbamoyl-3-[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl-methylamino]propanamide IUPAC Name: N-carbamoyl-3-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl-methylamino]propanamide Traditional Name: N-carbamoyl-3-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-amino]propionamide Formula: C21H22ClN5O2 MolecularWeight: 411.88468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClN5O2/c1-26(12-11-19(28)24-21(23)29)13-16-14-27(18-5-3-2-4-6-18)25-20(16)15-7-9-17(22)10-8-15/h2-10,14H,11-13H2,1H3,(H3,23,24,28,29)