2-(6-methoxy-4-oxidanylidene-1H-quinazolin-2-yl)-3-(4-methylsulfanylphenyl)prop-2-enenitrile

Systemtic Name: 2-(6-methoxy-4-oxidanylidene-1H-quinazolin-2-yl)-3-(4-methylsulfanylphenyl)prop-2-enenitrile Openeye Name: 2-(6-methoxy-4-oxo-1H-quinazolin-2-yl)-3-(4-methylsulfanylphenyl)prop-2-enenitrile CAS Name: 2-(6-methoxy-4-oxo-1H-quinazolin-2-yl)-3-[4-(methylthio)phenyl]-2-propenenitrile IUPAC Name: 2-(6-methoxy-4-oxo-1H-quinazolin-2-yl)-3-(4-methylsulfanylphenyl)prop-2-enenitrile Traditional Name: 2-(4-keto-6-methoxy-1H-quinazolin-2-yl)-3-[4-(methylthio)phenyl]acrylonitrile Formula: C19H15N3O2S MolecularWeight: 349.4063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=NC2=O)C(=CC3=CC=C(C=C3)SC)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=NC2=O)C(=CC3=CC=C(C=C3)SC)C#N

InChI

InChI=1S/C19H15N3O2S/c1-24-14-5-8-17-16(10-14)19(23)22-18(21-17)13(11-20)9-12-3-6-15(25-2)7-4-12/h3-10H,1-2H3,(H,21,22,23)