N-[3-[(4-cyanophenyl)methyl]-2-methyl-4-oxidanylidene-quinazolin-6-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-[(4-cyanophenyl)methyl]-2-methyl-4-oxidanylidene-quinazolin-6-yl]thiophene-2-carboxamide Openeye Name: N-[3-[(4-cyanophenyl)methyl]-2-methyl-4-oxo-quinazolin-6-yl]thiophene-2-carboxamide CAS Name: N-[3-[(4-cyanophenyl)methyl]-2-methyl-4-oxo-6-quinazolinyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[(4-cyanophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]thiophene-2-carboxamide Traditional Name: N-[3-(4-cyanobenzyl)-4-keto-2-methyl-quinazolin-6-yl]thiophene-2-carboxamide Formula: C22H16N4O2S MolecularWeight: 400.45304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC(=O)C3=CC=CS3)C(=O)N1CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC(=O)C3=CC=CS3)C(=O)N1CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H16N4O2S/c1-14-24-19-9-8-17(25-21(27)20-3-2-10-29-20)11-18(19)22(28)26(14)13-16-6-4-15(12-23)5-7-16/h2-11H,13H2,1H3,(H,25,27)