6-oxidanyl-3-phenethyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6-oxidanyl-3-phenethyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6-hydroxy-3-phenethyl-2-thioxo-1H-quinazolin-4-one CAS Name: 6-hydroxy-3-phenethyl-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6-hydroxy-3-phenethyl-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6-hydroxy-3-phenethyl-2-thioxo-1H-quinazolin-4-one Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C3=C(C=CC(=C3)O)NC2=S

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C3=C(C=CC(=C3)O)NC2=S

InChI

InChI=1S/C16H14N2O2S/c19-12-6-7-14-13(10-12)15(20)18(16(21)17-14)9-8-11-4-2-1-3-5-11/h1-7,10,19H,8-9H2,(H,17,21)