N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-methyl-N-[[4-(1-piperidyl)phenyl]methyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-methyl-N-[[4-(1-piperidinyl)phenyl]methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-methyl-N-(4-piperidinobenzyl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C21H25N5OS2 MolecularWeight: 427.5861

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)N2CCCCC2)C(=O)CN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

CN(CC1=CC=C(C=C1)N2CCCCC2)C(=O)CN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C21H25N5OS2/c1-24(14-16-7-9-17(10-8-16)25-11-3-2-4-12-25)19(27)15-26-20(22-23-21(26)28)18-6-5-13-29-18/h5-10,13H,2-4,11-12,14-15H2,1H3,(H,23,28)