3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]propanamide

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-propionamide Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)N(C)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)N(C)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H24N6O2/c1-14-16(15(2)27(25-14)12-6-11-22)9-10-20(28)26(3)13-19-23-18-8-5-4-7-17(18)21(29)24-19/h4-5,7-8H,6,9-10,12-13H2,1-3H3,(H,23,24,29)