[1-(6-chloranylpyridazin-3-yl)piperidin-3-yl]-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [1-(6-chloranylpyridazin-3-yl)piperidin-3-yl]-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [1-(6-chloropyridazin-3-yl)-3-piperidyl]-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [1-(6-chloro-3-pyridazinyl)-3-piperidinyl]-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [1-(6-chloropyridazin-3-yl)piperidin-3-yl]-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [1-(6-chloropyridazin-3-yl)-3-piperidyl]-(4-p-phenetylsulfonylpiperazino)methanone Formula: C22H28ClN5O4S MolecularWeight: 494.00682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCCN(C3)C4=NN=C(C=C4)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCCN(C3)C4=NN=C(C=C4)Cl

InChI

InChI=1S/C22H28ClN5O4S/c1-2-32-18-5-7-19(8-6-18)33(30,31)28-14-12-26(13-15-28)22(29)17-4-3-11-27(16-17)21-10-9-20(23)24-25-21/h5-10,17H,2-4,11-16H2,1H3