6-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]carbonyl-2-(4-methylphenyl)-1,4-dihydropyridazin-3-one

Systemtic Name: 6-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]carbonyl-2-(4-methylphenyl)-1,4-dihydropyridazin-3-one Openeye Name: 6-[4-[(5-bromo-2-thienyl)sulfonyl]piperazine-1-carbonyl]-2-(p-tolyl)-1,4-dihydropyridazin-3-one CAS Name: 6-[[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-oxomethyl]-2-(4-methylphenyl)-1,4-dihydropyridazin-3-one IUPAC Name: 6-[4-(5-bromothiophen-2-yl)sulfonylpiperazine-1-carbonyl]-2-(4-methylphenyl)-1,4-dihydropyridazin-3-one Traditional Name: 6-[4-[(5-bromo-2-thienyl)sulfonyl]piperazine-1-carbonyl]-2-(p-tolyl)-1,4-dihydropyridazin-3-one Formula: C20H21BrN4O4S2 MolecularWeight: 525.43914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)CC=C(N2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)CC=C(N2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C20H21BrN4O4S2/c1-14-2-4-15(5-3-14)25-18(26)8-6-16(22-25)20(27)23-10-12-24(13-11-23)31(28,29)19-9-7-17(21)30-19/h2-7,9,22H,8,10-13H2,1H3