6-[4-[4-[(E)-2-(5-chloranylthiophen-2-yl)ethenyl]sulfonylpiperazin-1-yl]carbonylpiperidin-1-yl]-2-methyl-pyridazin-3-one

Systemtic Name: 6-[4-[4-[(E)-2-(5-chloranylthiophen-2-yl)ethenyl]sulfonylpiperazin-1-yl]carbonylpiperidin-1-yl]-2-methyl-pyridazin-3-one Openeye Name: 6-[4-[4-[(E)-2-(5-chloro-2-thienyl)vinyl]sulfonylpiperazine-1-carbonyl]-1-piperidyl]-2-methyl-pyridazin-3-one CAS Name: 6-[4-[[4-[(E)-2-(5-chloro-2-thiophenyl)ethenyl]sulfonyl-1-piperazinyl]-oxomethyl]-1-piperidinyl]-2-methyl-3-pyridazinone IUPAC Name: 6-[4-[4-[(E)-2-(5-chlorothiophen-2-yl)ethenyl]sulfonylpiperazine-1-carbonyl]piperidin-1-yl]-2-methylpyridazin-3-one Traditional Name: 6-[4-[4-[(E)-2-(5-chloro-2-thienyl)vinyl]sulfonylpiperazine-1-carbonyl]piperidino]-2-methyl-pyridazin-3-one Formula: C21H26ClN5O4S2 MolecularWeight: 512.04524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CC(=N1)N2CCC(CC2)C(=O)N3CCN(CC3)S(=O)(=O)C=CC4=CC=C(S4)Cl

Isomeric SMILES

CN1C(=O)C=CC(=N1)N2CCC(CC2)C(=O)N3CCN(CC3)S(=O)(=O)/C=C/C4=CC=C(S4)Cl

InChI

InChI=1S/C21H26ClN5O4S2/c1-24-20(28)5-4-19(23-24)25-9-6-16(7-10-25)21(29)26-11-13-27(14-12-26)33(30,31)15-8-17-2-3-18(22)32-17/h2-5,8,15-16H,6-7,9-14H2,1H3/b15-8+