N-[1-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide

Systemtic Name: N-[1-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-1-oxidanylidene-propan-2-yl]furan-2-carboxamide Openeye Name: N-[2-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-1-methyl-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[1-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propylamino]-1-oxopropan-2-yl]-2-furancarboxamide IUPAC Name: N-[1-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propylamino]-1-oxopropan-2-yl]furan-2-carboxamide Traditional Name: N-[2-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propylamino]-2-keto-1-methyl-ethyl]-2-furamide Formula: C21H22N6O3 MolecularWeight: 406.43778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCC1=NN(C(=C1C#N)N)C2=CC=CC=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

CC(C(=O)NCCCC1=NN(C(=C1C#N)N)C2=CC=CC=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H22N6O3/c1-14(25-21(29)18-10-6-12-30-18)20(28)24-11-5-9-17-16(13-22)19(23)27(26-17)15-7-3-2-4-8-15/h2-4,6-8,10,12,14H,5,9,11,23H2,1H3,(H,24,28)(H,25,29)