N,N-diethyl-3-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-1-methyl-4-oxidanylidene-quinoline-6-sulfonamide

Systemtic Name: N,N-diethyl-3-[4-(4-fluorophenyl)piperazin-1-yl]carbonyl-1-methyl-4-oxidanylidene-quinoline-6-sulfonamide Openeye Name: N,N-diethyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-1-methyl-4-oxo-quinoline-6-sulfonamide CAS Name: N,N-diethyl-3-[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]-1-methyl-4-oxo-6-quinolinesulfonamide IUPAC Name: N,N-diethyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-1-methyl-4-oxoquinoline-6-sulfonamide Traditional Name: N,N-diethyl-3-[4-(4-fluorophenyl)piperazine-1-carbonyl]-4-keto-1-methyl-quinoline-6-sulfonamide Formula: C25H29FN4O4S MolecularWeight: 500.585563

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C=C(C2=O)C(=O)N3CCN(CC3)C4=CC=C(C=C4)F)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C=C(C2=O)C(=O)N3CCN(CC3)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C25H29FN4O4S/c1-4-30(5-2)35(33,34)20-10-11-23-21(16-20)24(31)22(17-27(23)3)25(32)29-14-12-28(13-15-29)19-8-6-18(26)7-9-19/h6-11,16-17H,4-5,12-15H2,1-3H3