7-[4-[3,4-bis(fluoranyl)phenyl]carbonylpiperazin-1-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 7-[4-[3,4-bis(fluoranyl)phenyl]carbonylpiperazin-1-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[[4-[(3,4-difluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-[4-(3,4-difluorobenzoyl)piperazine-1-carbonyl]-2-thioxo-1H-quinazolin-4-one Formula: C20H16F2N4O3S MolecularWeight: 430.427846

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3)C(=O)C4=CC(=C(C=C4)F)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3)C(=O)C4=CC(=C(C=C4)F)F

InChI

InChI=1S/C20H16F2N4O3S/c21-14-4-2-11(9-15(14)22)18(28)25-5-7-26(8-6-25)19(29)12-1-3-13-16(10-12)23-20(30)24-17(13)27/h1-4,9-10H,5-8H2,(H2,23,24,27,30)