N-[[2-(dimethylaminomethyl)phenyl]methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[2-(dimethylaminomethyl)benzyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C19H23N5OS2 MolecularWeight: 401.54882

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CNC(=O)CCN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

CN(C)CC1=CC=CC=C1CNC(=O)CCN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C19H23N5OS2/c1-23(2)13-15-7-4-3-6-14(15)12-20-17(25)9-10-24-18(21-22-19(24)26)16-8-5-11-27-16/h3-8,11H,9-10,12-13H2,1-2H3,(H,20,25)(H,22,26)