2-(4-azanyl-2-sulfanylidene-quinazolin-3-yl)-1-(4-chlorophenyl)ethanone

Systemtic Name: 2-(4-azanyl-2-sulfanylidene-quinazolin-3-yl)-1-(4-chlorophenyl)ethanone Openeye Name: 2-(4-amino-2-thioxo-quinazolin-3-yl)-1-(4-chlorophenyl)ethanone CAS Name: 2-(4-amino-2-sulfanylidene-3-quinazolinyl)-1-(4-chlorophenyl)ethanone IUPAC Name: 2-(4-amino-2-sulfanylidenequinazolin-3-yl)-1-(4-chlorophenyl)ethanone Traditional Name: 2-(4-amino-2-thioxo-quinazolin-3-yl)-1-(4-chlorophenyl)ethanone Formula: C16H12ClN3OS MolecularWeight: 329.80398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(N(C(=S)N=C2C=C1)CC(=O)C3=CC=C(C=C3)Cl)N

Isomeric SMILES

C1=CC2=C(N(C(=S)N=C2C=C1)CC(=O)C3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C16H12ClN3OS/c17-11-7-5-10(6-8-11)14(21)9-20-15(18)12-3-1-2-4-13(12)19-16(20)22/h1-8H,9,18H2