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

Systemtic Name: N-(benzimidazol-1-yl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-(benzimidazol-1-yl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(1-benzimidazolyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-(benzimidazol-1-yl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-(benzimidazol-1-yl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C16H14N6OS2 MolecularWeight: 370.45196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2NC(=O)CCN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2NC(=O)CCN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C16H14N6OS2/c23-14(20-22-10-17-11-4-1-2-5-12(11)22)7-8-21-15(18-19-16(21)24)13-6-3-9-25-13/h1-6,9-10H,7-8H2,(H,19,24)(H,20,23)