N-[2-(2-methylbenzimidazol-1-yl)ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-[2-(2-methylbenzimidazol-1-yl)ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[2-(2-methylbenzimidazol-1-yl)ethyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[2-(2-methyl-1-benzimidazolyl)ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[2-(2-methylbenzimidazol-1-yl)ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[2-(2-methylbenzimidazol-1-yl)ethyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C19H20N6OS2 MolecularWeight: 412.5317

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CCNC(=O)CCN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CCNC(=O)CCN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C19H20N6OS2/c1-13-21-14-5-2-3-6-15(14)24(13)11-9-20-17(26)8-10-25-18(22-23-19(25)27)16-7-4-12-28-16/h2-7,12H,8-11H2,1H3,(H,20,26)(H,23,27)