1-phenyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]pyrazole-4-carboxamide

Systemtic Name: 1-phenyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]pyrazole-4-carboxamide Openeye Name: N-[[4-(isopropylcarbamoylamino)phenyl]methyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 1-phenyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]pyrazole-4-carboxamide Traditional Name: N-[4-(isopropylcarbamoylamino)benzyl]-1-phenyl-pyrazole-4-carboxamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H23N5O2/c1-15(2)24-21(28)25-18-10-8-16(9-11-18)12-22-20(27)17-13-23-26(14-17)19-6-4-3-5-7-19/h3-11,13-15H,12H2,1-2H3,(H,22,27)(H2,24,25,28)