N-[3-(2,3-dihydro-1,4-benzodioxin-3-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzamide

Systemtic Name: N-[3-(2,3-dihydro-1,4-benzodioxin-3-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzamide Openeye Name: N-[3-(2,3-dihydro-1,4-benzodioxin-3-yl)-5-thioxo-1H-1,2,4-triazol-4-yl]benzamide CAS Name: N-[3-(2,3-dihydro-1,4-benzodioxin-3-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzamide IUPAC Name: N-[3-(2,3-dihydro-1,4-benzodioxin-3-yl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzamide Traditional Name: N-[3-(2,3-dihydro-1,4-benzodioxin-3-yl)-5-thioxo-1H-1,2,4-triazol-4-yl]benzamide Formula: C17H14N4O3S MolecularWeight: 354.38306

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C3=NNC(=S)N3NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)C3=NNC(=S)N3NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C17H14N4O3S/c22-16(11-6-2-1-3-7-11)20-21-15(18-19-17(21)25)14-10-23-12-8-4-5-9-13(12)24-14/h1-9,14H,10H2,(H,19,25)(H,20,22)