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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C16H14N4O3S2 MolecularWeight: 374.43736

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CCN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CCN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C16H14N4O3S2/c21-14(17-10-3-4-11-12(8-10)23-9-22-11)5-6-20-15(18-19-16(20)24)13-2-1-7-25-13/h1-4,7-8H,5-6,9H2,(H,17,21)(H,19,24)