N-(3-chloranyl-4-methoxy-phenyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-[(5-piperidinosulfonyl-2-pyridyl)thio]acetamide Formula: C19H22ClN3O4S2 MolecularWeight: 455.97868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C19H22ClN3O4S2/c1-27-17-7-5-14(11-16(17)20)22-18(24)13-28-19-8-6-15(12-21-19)29(25,26)23-9-3-2-4-10-23/h5-8,11-12H,2-4,9-10,13H2,1H3,(H,22,24)