3-(4-methoxyphenyl)-2-sulfanylidene-1H-quinazolin-4-one; piperazine

Systemtic Name: 3-(4-methoxyphenyl)-2-sulfanylidene-1H-quinazolin-4-one; piperazine Openeye Name: 3-(4-methoxyphenyl)-2-thioxo-1H-quinazolin-4-one; piperazine CAS Name: 3-(4-methoxyphenyl)-2-sulfanylidene-1H-quinazolin-4-one; piperazine IUPAC Name: 3-(4-methoxyphenyl)-2-sulfanylidene-1H-quinazolin-4-one; piperazine Traditional Name: 3-(4-methoxyphenyl)-2-thioxo-1H-quinazolin-4-one; piperazine Formula: C34H34N6O4S2 MolecularWeight: 654.80156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3NC2=S.COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3NC2=S.C1CNCCN1

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3NC2=S.COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3NC2=S.C1CNCCN1

InChI

InChI=1S/2C15H12N2O2S.C4H10N2/c2*1-19-11-8-6-10(7-9-11)17-14(18)12-4-2-3-5-13(12)16-15(17)20;1-2-6-4-3-5-1/h2*2-9H,1H3,(H,16,20);5-6H,1-4H2