N-(1H-benzimidazol-2-ylmethyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C17H16N6OS2 MolecularWeight: 384.47854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CNC(=O)CCN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CNC(=O)CCN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C17H16N6OS2/c24-15(18-10-14-19-11-4-1-2-5-12(11)20-14)7-8-23-16(21-22-17(23)25)13-6-3-9-26-13/h1-6,9H,7-8,10H2,(H,18,24)(H,19,20)(H,22,25)