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

Systemtic Name: N-[4-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-4-oxidanylidene-butyl]-4-methoxy-benzamide Openeye Name: N-[4-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-4-oxo-butyl]-4-methoxy-benzamide CAS Name: N-[4-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propylamino]-4-oxobutyl]-4-methoxybenzamide IUPAC Name: N-[4-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propylamino]-4-oxobutyl]-4-methoxybenzamide Traditional Name: N-[4-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-4-keto-butyl]-4-methoxy-benzamide Formula: C25H28N6O3 MolecularWeight: 460.52822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCCCC(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NCCCC(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3

InChI

InChI=1S/C25H28N6O3/c1-34-20-13-11-18(12-14-20)25(33)29-16-6-10-23(32)28-15-5-9-22-21(17-26)24(27)31(30-22)19-7-3-2-4-8-19/h2-4,7-8,11-14H,5-6,9-10,15-16,27H2,1H3,(H,28,32)(H,29,33)