3-[(2-methoxyphenyl)methyl]-7-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[(2-methoxyphenyl)methyl]-7-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[(2-methoxyphenyl)methyl]-7-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(2-methoxyphenyl)methyl]-7-[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[(2-methoxyphenyl)methyl]-7-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-3-o-anisyl-2-thioxo-1H-quinazolin-4-one Formula: C28H28N4O4S MolecularWeight: 516.61132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2C(=O)C3=C(C=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5OC)NC2=S

Isomeric SMILES

COC1=CC=CC=C1CN2C(=O)C3=C(C=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5OC)NC2=S

InChI

InChI=1S/C28H28N4O4S/c1-35-24-9-5-3-7-20(24)18-32-27(34)21-12-11-19(17-22(21)29-28(32)37)26(33)31-15-13-30(14-16-31)23-8-4-6-10-25(23)36-2/h3-12,17H,13-16,18H2,1-2H3,(H,29,37)