N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]pyridine-2-carboxamide

Systemtic Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]pyridine-2-carboxamide Openeye Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]pyridine-2-carboxamide CAS Name: N-[[5-(2-dimethylaminoethylthio)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-2-pyridinecarboxamide IUPAC Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]pyridine-2-carboxamide Traditional Name: N-[[5-(2-dimethylaminoethylthio)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]picolinamide Formula: C20H24N6O2S MolecularWeight: 412.50856

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=NN=C(N1C2=CC(=CC=C2)OC)CNC(=O)C3=CC=CC=N3

Isomeric SMILES

CN(C)CCSC1=NN=C(N1C2=CC(=CC=C2)OC)CNC(=O)C3=CC=CC=N3

InChI

InChI=1S/C20H24N6O2S/c1-25(2)11-12-29-20-24-23-18(14-22-19(27)17-9-4-5-10-21-17)26(20)15-7-6-8-16(13-15)28-3/h4-10,13H,11-12,14H2,1-3H3,(H,22,27)