N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2,3-diethyl-quinoxaline-6-carboxamide

Systemtic Name: N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2,3-diethyl-quinoxaline-6-carboxamide Openeye Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2,3-diethyl-quinoxaline-6-carboxamide CAS Name: N-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propyl]-2,3-diethyl-6-quinoxalinecarboxamide IUPAC Name: N-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propyl]-2,3-diethylquinoxaline-6-carboxamide Traditional Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2,3-diethyl-quinoxaline-6-carboxamide Formula: C26H27N7O MolecularWeight: 453.53888

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2)C(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=CC=C4)N=C1CC

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2)C(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=CC=C4)N=C1CC

InChI

InChI=1S/C26H27N7O/c1-3-20-21(4-2)31-24-15-17(12-13-23(24)30-20)26(34)29-14-8-11-22-19(16-27)25(28)33(32-22)18-9-6-5-7-10-18/h5-7,9-10,12-13,15H,3-4,8,11,14,28H2,1-2H3,(H,29,34)