N-[2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]thiophene-2-carboxamide Openeye Name: N-[2-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]thiophene-2-carboxamide CAS Name: N-[2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]thiophene-2-carboxamide Traditional Name: N-[2-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]thio]acetyl]thiophene-2-carboxamide Formula: C16H14N4O2S2 MolecularWeight: 358.43796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)NC(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)NC(=O)C3=CC=CS3

InChI

InChI=1S/C16H14N4O2S2/c1-10-4-6-11(7-5-10)14-18-16(20-19-14)24-9-13(21)17-15(22)12-3-2-8-23-12/h2-8H,9H2,1H3,(H,17,21,22)(H,18,19,20)