4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carbothioyl chloride

Systemtic Name: 4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carbothioyl chloride Openeye Name: 4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carbothioyl chloride CAS Name: 4-(6,7-dimethoxy-4-quinazolinyl)-1-piperazinecarbothioyl chloride IUPAC Name: 4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carbothioyl chloride Traditional Name: 4-(6,7-dimethoxyquinazolin-4-yl)piperazine-1-carbothioyl chloride Formula: C15H17ClN4O2S MolecularWeight: 352.83908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=S)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=S)Cl)OC

InChI

InChI=1S/C15H17ClN4O2S/c1-21-12-7-10-11(8-13(12)22-2)17-9-18-14(10)19-3-5-20(6-4-19)15(16)23/h7-9H,3-6H2,1-2H3