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

Systemtic Name: N-[(4-piperidin-1-ylcarbonylphenyl)methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[[4-(piperidine-1-carbonyl)phenyl]methyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-[[4-[oxo(1-piperidinyl)methyl]phenyl]methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[[4-(piperidine-1-carbonyl)phenyl]methyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[4-(piperidine-1-carbonyl)benzyl]-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C21H23N5O2S2 MolecularWeight: 441.56962

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=C(C=C2)CNC(=O)CN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=C(C=C2)CNC(=O)CN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C21H23N5O2S2/c27-18(14-26-19(23-24-21(26)29)17-5-4-12-30-17)22-13-15-6-8-16(9-7-15)20(28)25-10-2-1-3-11-25/h4-9,12H,1-3,10-11,13-14H2,(H,22,27)(H,24,29)