6-chloranyl-3-(4-ethanoylphenyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6-chloranyl-3-(4-ethanoylphenyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(4-acetylphenyl)-6-chloro-2-thioxo-1H-quinazolin-4-one CAS Name: 3-(4-acetylphenyl)-6-chloro-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(4-acetylphenyl)-6-chloro-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(4-acetylphenyl)-6-chloro-2-thioxo-1H-quinazolin-4-one Formula: C16H11ClN2O2S MolecularWeight: 330.78874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C=CC(=C3)Cl)NC2=S

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C=CC(=C3)Cl)NC2=S

InChI

InChI=1S/C16H11ClN2O2S/c1-9(20)10-2-5-12(6-3-10)19-15(21)13-8-11(17)4-7-14(13)18-16(19)22/h2-8H,1H3,(H,18,22)