2-[3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]-1H-quinazolin-4-one

Systemtic Name: 2-[3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]-1H-quinazolin-4-one Openeye Name: 2-[3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-3-oxo-propyl]-1H-quinazolin-4-one CAS Name: 2-[3-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-3-oxopropyl]-1H-quinazolin-4-one IUPAC Name: 2-[3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-3-oxopropyl]-1H-quinazolin-4-one Traditional Name: 2-[3-[4-(3-fluorophenyl)sulfonylpiperazino]-3-keto-propyl]-1H-quinazolin-4-one Formula: C21H21FN4O4S MolecularWeight: 444.479243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=NC(=O)C3=CC=CC=C3N2)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=NC(=O)C3=CC=CC=C3N2)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C21H21FN4O4S/c22-15-4-3-5-16(14-15)31(29,30)26-12-10-25(11-13-26)20(27)9-8-19-23-18-7-2-1-6-17(18)21(28)24-19/h1-7,14H,8-13H2,(H,23,24,28)