6-fluoranyl-3-[2-oxidanylidene-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]quinazolin-4-one

Systemtic Name: 6-fluoranyl-3-[2-oxidanylidene-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]quinazolin-4-one Openeye Name: 6-fluoro-3-[2-oxo-2-[4-(2-thienylsulfonyl)piperazin-1-yl]ethyl]quinazolin-4-one CAS Name: 6-fluoro-3-[2-oxo-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethyl]-4-quinazolinone IUPAC Name: 6-fluoro-3-[2-oxo-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethyl]quinazolin-4-one Traditional Name: 6-fluoro-3-[2-keto-2-[4-(2-thienylsulfonyl)piperazino]ethyl]quinazolin-4-one Formula: C18H17FN4O4S2 MolecularWeight: 436.480383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)F)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H17FN4O4S2/c19-13-3-4-15-14(10-13)18(25)22(12-20-15)11-16(24)21-5-7-23(8-6-21)29(26,27)17-2-1-9-28-17/h1-4,9-10,12H,5-8,11H2