1-[2-(3-chloranyl-4-oxidanyl-phenyl)-5-(2-methylsulfanylpropan-2-yl)pyrazol-3-yl]-3-[[2-[[3-[3-(2-hydroxyethyloxy)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-yl]sulfanyl]phenyl]methyl]urea

Systemtic Name: 1-[2-(3-chloranyl-4-oxidanyl-phenyl)-5-(2-methylsulfanylpropan-2-yl)pyrazol-3-yl]-3-[[2-[[3-[3-(2-hydroxyethyloxy)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-yl]sulfanyl]phenyl]methyl]urea Openeye Name: 1-[2-(3-chloro-4-hydroxy-phenyl)-5-(1-methyl-1-methylsulfanyl-ethyl)pyrazol-3-yl]-3-[[2-[[3-[3-(2-hydroxyethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-yl]sulfanyl]phenyl]methyl]urea CAS Name: 1-[2-(3-chloro-4-hydroxyphenyl)-5-[2-(methylthio)propan-2-yl]-3-pyrazolyl]-3-[[2-[[3-[3-(2-hydroxyethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-yl]thio]phenyl]methyl]urea IUPAC Name: 1-[2-(3-chloro-4-hydroxyphenyl)-5-(2-methylsulfanylpropan-2-yl)pyrazol-3-yl]-3-[[2-[[3-[3-(2-hydroxyethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-yl]sulfanyl]phenyl]methyl]urea Traditional Name: 1-[2-(3-chloro-4-hydroxy-phenyl)-5-[1-methyl-1-(methylthio)ethyl]pyrazol-3-yl]-3-[2-[[3-[3-(2-hydroxyethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-6-yl]thio]benzyl]urea Formula: C35H34ClN7O4S2 MolecularWeight: 716.27196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=NN(C(=C1)NC(=O)NCC2=CC=CC=C2SC3=CN4C(=NN=C4C5=CC(=CC=C5)OCCO)C=C3)C6=CC(=C(C=C6)O)Cl)SC

Isomeric SMILES

CC(C)(C1=NN(C(=C1)NC(=O)NCC2=CC=CC=C2SC3=CN4C(=NN=C4C5=CC(=CC=C5)OCCO)C=C3)C6=CC(=C(C=C6)O)Cl)SC

InChI

InChI=1S/C35H34ClN7O4S2/c1-35(2,48-3)30-19-32(43(41-30)24-11-13-28(45)27(36)18-24)38-34(46)37-20-23-7-4-5-10-29(23)49-26-12-14-31-39-40-33(42(31)21-26)22-8-6-9-25(17-22)47-16-15-44/h4-14,17-19,21,44-45H,15-16,20H2,1-3H3,(H2,37,38,46)