3-(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-quinazolin-1-yl)propanenitrile

Systemtic Name: 3-(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-quinazolin-1-yl)propanenitrile Openeye Name: 3-(3-allyl-4-oxo-2-thioxo-quinazolin-1-yl)propanenitrile CAS Name: 3-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1-quinazolinyl)propanenitrile IUPAC Name: 3-(4-oxo-3-prop-2-enyl-2-sulfanylidenequinazolin-1-yl)propanenitrile Traditional Name: 3-(3-allyl-4-keto-2-thioxo-quinazolin-1-yl)propionitrile Formula: C14H13N3OS MolecularWeight: 271.33752

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N(C1=S)CCC#N

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N(C1=S)CCC#N

InChI

InChI=1S/C14H13N3OS/c1-2-9-17-13(18)11-6-3-4-7-12(11)16(14(17)19)10-5-8-15/h2-4,6-7H,1,5,9-10H2