N-[2-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: N-[2-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-2-oxidanylidene-ethyl]benzamide Openeye Name: N-[2-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-2-oxo-ethyl]benzamide CAS Name: N-[2-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propylamino]-2-oxoethyl]benzamide IUPAC Name: N-[2-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propylamino]-2-oxoethyl]benzamide Traditional Name: N-[2-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-2-keto-ethyl]benzamide Formula: C22H22N6O2 MolecularWeight: 402.44908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCC(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCC(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3

InChI

InChI=1S/C22H22N6O2/c23-14-18-19(27-28(21(18)24)17-10-5-2-6-11-17)12-7-13-25-20(29)15-26-22(30)16-8-3-1-4-9-16/h1-6,8-11H,7,12-13,15,24H2,(H,25,29)(H,26,30)