5-chloranyl-N-[[1-[2-(3-methylsulfonylpropoxy)-4-(2-oxidanylidenepyridin-1-yl)phenyl]-1,2,3-triazol-4-yl]methyl]thiophene-2-carboxamide

Systemtic Name: 5-chloranyl-N-[[1-[2-(3-methylsulfonylpropoxy)-4-(2-oxidanylidenepyridin-1-yl)phenyl]-1,2,3-triazol-4-yl]methyl]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[[1-[2-(3-methylsulfonylpropoxy)-4-(2-oxo-1-pyridyl)phenyl]triazol-4-yl]methyl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[[1-[2-(3-methylsulfonylpropoxy)-4-(2-oxo-1-pyridinyl)phenyl]-4-triazolyl]methyl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[[1-[2-(3-methylsulfonylpropoxy)-4-(2-oxopyridin-1-yl)phenyl]triazol-4-yl]methyl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[[1-[4-(2-keto-1-pyridyl)-2-(3-mesylpropoxy)phenyl]triazol-4-yl]methyl]thiophene-2-carboxamide Formula: C23H22ClN5O5S2 MolecularWeight: 548.03428

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCCOC1=C(C=CC(=C1)N2C=CC=CC2=O)N3C=C(N=N3)CNC(=O)C4=CC=C(S4)Cl

Isomeric SMILES

CS(=O)(=O)CCCOC1=C(C=CC(=C1)N2C=CC=CC2=O)N3C=C(N=N3)CNC(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C23H22ClN5O5S2/c1-36(32,33)12-4-11-34-19-13-17(28-10-3-2-5-22(28)30)6-7-18(19)29-15-16(26-27-29)14-25-23(31)20-8-9-21(24)35-20/h2-3,5-10,13,15H,4,11-12,14H2,1H3,(H,25,31)