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

Systemtic Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide Openeye Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide CAS Name: N-[[5-(2-dimethylaminoethylthio)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide Traditional Name: N-[[5-(2-dimethylaminoethylthio)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]thiophene-2-carboxamide Formula: C19H23N5O2S2 MolecularWeight: 417.54822

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=NN=C(N1C2=CC(=CC=C2)OC)CNC(=O)C3=CC=CS3

Isomeric SMILES

CN(C)CCSC1=NN=C(N1C2=CC(=CC=C2)OC)CNC(=O)C3=CC=CS3

InChI

InChI=1S/C19H23N5O2S2/c1-23(2)9-11-28-19-22-21-17(13-20-18(25)16-8-5-10-27-16)24(19)14-6-4-7-15(12-14)26-3/h4-8,10,12H,9,11,13H2,1-3H3,(H,20,25)