N-[4-(cyanomethyl)phenyl]-2-[2-methoxyethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-[2-methoxyethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-[2-methoxyethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-[2-methoxyethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-[2-methoxyethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-[(4-keto-1H-quinazolin-2-yl)methyl-(2-methoxyethyl)amino]acetamide Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C22H23N5O3/c1-30-13-12-27(14-20-25-19-5-3-2-4-18(19)22(29)26-20)15-21(28)24-17-8-6-16(7-9-17)10-11-23/h2-9H,10,12-15H2,1H3,(H,24,28)(H,25,26,29)