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

Systemtic Name: N-[2-(ethylamino)-2-oxidanylidene-ethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[2-(ethylamino)-2-oxo-ethyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[2-(ethylamino)-2-oxoethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[2-(ethylamino)-2-oxoethyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[2-(ethylamino)-2-keto-ethyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C13H17N5O2S2 MolecularWeight: 339.43638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CNC(=O)CCN1C(=NNC1=S)C2=CC=CS2

Isomeric SMILES

CCNC(=O)CNC(=O)CCN1C(=NNC1=S)C2=CC=CS2

InChI

InChI=1S/C13H17N5O2S2/c1-2-14-11(20)8-15-10(19)5-6-18-12(16-17-13(18)21)9-4-3-7-22-9/h3-4,7H,2,5-6,8H2,1H3,(H,14,20)(H,15,19)(H,17,21)