3-hexanoyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-hexanoyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-hexanoyl-2-thioxo-1H-quinazolin-4-one CAS Name: 3-(1-oxohexyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-hexanoyl-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-caproyl-2-thioxo-1H-quinazolin-4-one Formula: C14H16N2O2S MolecularWeight: 276.35404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1C(=O)C2=CC=CC=C2NC1=S

Isomeric SMILES

CCCCCC(=O)N1C(=O)C2=CC=CC=C2NC1=S

InChI

InChI=1S/C14H16N2O2S/c1-2-3-4-9-12(17)16-13(18)10-7-5-6-8-11(10)15-14(16)19/h5-8H,2-4,9H2,1H3,(H,15,19)