N-(3-cyanothiophen-2-yl)-4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide Openeye Name: N-(3-cyano-2-thienyl)-4-(8-methyl-4-oxo-quinazolin-3-yl)butanamide CAS Name: N-(3-cyano-2-thiophenyl)-4-(8-methyl-4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-(3-cyanothiophen-2-yl)-4-(8-methyl-4-oxoquinazolin-3-yl)butanamide Traditional Name: N-(3-cyano-2-thienyl)-4-(4-keto-8-methyl-quinazolin-3-yl)butyramide Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)NC3=C(C=CS3)C#N

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)NC3=C(C=CS3)C#N

InChI

InChI=1S/C18H16N4O2S/c1-12-4-2-5-14-16(12)20-11-22(18(14)24)8-3-6-15(23)21-17-13(10-19)7-9-25-17/h2,4-5,7,9,11H,3,6,8H2,1H3,(H,21,23)