N-[4-[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]benzamide

Systemtic Name: N-[4-[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]benzamide Openeye Name: N-[4-[2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]phenyl]benzamide CAS Name: N-[4-[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]phenyl]benzamide IUPAC Name: N-[4-[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]benzamide Traditional Name: N-[4-[2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]phenyl]benzamide Formula: C22H18N4O2S2 MolecularWeight: 434.53392

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C22H18N4O2S2/c1-26-20(19-8-5-13-29-19)24-25-22(26)30-14-18(27)15-9-11-17(12-10-15)23-21(28)16-6-3-2-4-7-16/h2-13H,14H2,1H3,(H,23,28)