N-(2-phenoxyphenyl)-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-phenoxyphenyl)-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-phenoxyphenyl)-2-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-phenoxyphenyl)-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-phenoxyphenyl)-2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-phenoxyphenyl)-2-[[5-(2-thenyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)CSC3=NNC(=N3)CC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)CSC3=NNC(=N3)CC4=CC=CS4

InChI

InChI=1S/C21H18N4O2S2/c26-20(14-29-21-23-19(24-25-21)13-16-9-6-12-28-16)22-17-10-4-5-11-18(17)27-15-7-2-1-3-8-15/h1-12H,13-14H2,(H,22,26)(H,23,24,25)