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

Systemtic Name: 3-(2-fluorophenyl)-7-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(2-fluorophenyl)-7-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-(2-fluorophenyl)-7-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(2-fluorophenyl)-7-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(2-fluorophenyl)-7-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-2-thioxo-1H-quinazolin-4-one Formula: C26H23FN4O3S MolecularWeight: 490.549223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C5=CC=CC=C5F

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C5=CC=CC=C5F

InChI

InChI=1S/C26H23FN4O3S/c1-34-19-9-7-18(8-10-19)29-12-14-30(15-13-29)24(32)17-6-11-20-22(16-17)28-26(35)31(25(20)33)23-5-3-2-4-21(23)27/h2-11,16H,12-15H2,1H3,(H,28,35)