2-ethanimidoyl-3-oxidanylidene-4-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-butanenitrile

Systemtic Name: 2-ethanimidoyl-3-oxidanylidene-4-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-butanenitrile Openeye Name: 2-ethanimidoyl-3-oxo-4-[2-(2-thienyl)quinazolin-4-yl]sulfanyl-butanenitrile CAS Name: 2-(1-iminoethyl)-3-oxo-4-[(2-thiophen-2-yl-4-quinazolinyl)thio]butanenitrile IUPAC Name: 2-ethanimidoyl-3-oxo-4-(2-thiophen-2-ylquinazolin-4-yl)sulfanylbutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[[2-(2-thienyl)quinazolin-4-yl]thio]butyronitrile Formula: C18H14N4OS2 MolecularWeight: 366.45996

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NC(=NC2=CC=CC=C21)C3=CC=CS3

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NC(=NC2=CC=CC=C21)C3=CC=CS3

InChI

InChI=1S/C18H14N4OS2/c1-11(20)13(9-19)15(23)10-25-18-12-5-2-3-6-14(12)21-17(22-18)16-7-4-8-24-16/h2-8,13,20H,10H2,1H3