1-phenyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]-3-pyridin-3-yl-pyrazole-4-carboxamide

Systemtic Name: 1-phenyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: N-[4-(allylcarbamoylamino)phenyl]-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-[4-[[oxo-(prop-2-enylamino)methyl]amino]phenyl]-1-phenyl-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: 1-phenyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: N-[4-(allylcarbamoylamino)phenyl]-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C25H22N6O2 MolecularWeight: 438.48118

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C=CCNC(=O)NC1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N6O2/c1-2-14-27-25(33)29-20-12-10-19(11-13-20)28-24(32)22-17-31(21-8-4-3-5-9-21)30-23(22)18-7-6-15-26-16-18/h2-13,15-17H,1,14H2,(H,28,32)(H2,27,29,33)