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

Systemtic Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-3-(2-methoxyethyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-[4-(4-fluorophenyl)piperazine-1-carbonyl]-3-(2-methoxyethyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]-3-(2-methoxyethyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-[4-(4-fluorophenyl)piperazine-1-carbonyl]-3-(2-methoxyethyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-[4-(4-fluorophenyl)piperazine-1-carbonyl]-3-(2-methoxyethyl)-2-thioxo-1H-quinazolin-4-one Formula: C22H23FN4O3S MolecularWeight: 442.506423

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)F)NC1=S

Isomeric SMILES

COCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)F)NC1=S

InChI

InChI=1S/C22H23FN4O3S/c1-30-13-12-27-21(29)18-7-2-15(14-19(18)24-22(27)31)20(28)26-10-8-25(9-11-26)17-5-3-16(23)4-6-17/h2-7,14H,8-13H2,1H3,(H,24,31)