[3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl N,N-diethylcarbamodithioate

Systemtic Name: [3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl N,N-diethylcarbamodithioate Openeye Name: [3-(cyanomethyl)-4-oxo-quinazolin-2-yl]methyl N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [3-(cyanomethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(cyanomethyl)-4-oxoquinazolin-2-yl]methyl N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [3-(cyanomethyl)-4-keto-quinazolin-2-yl]methyl ester Formula: C16H18N4OS2 MolecularWeight: 346.47032

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC1=NC2=CC=CC=C2C(=O)N1CC#N

Isomeric SMILES

CCN(CC)C(=S)SCC1=NC2=CC=CC=C2C(=O)N1CC#N

InChI

InChI=1S/C16H18N4OS2/c1-3-19(4-2)16(22)23-11-14-18-13-8-6-5-7-12(13)15(21)20(14)10-9-17/h5-8H,3-4,10-11H2,1-2H3