2-[[4-(4-butylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[4-(4-butylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-(4-butylphenyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-(4-butylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[4-(4-butylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-(4-butylphenyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C18H20N4OS2 MolecularWeight: 372.5076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N)C3=CC=CS3

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N)C3=CC=CS3

InChI

InChI=1S/C18H20N4OS2/c1-2-3-5-13-7-9-14(10-8-13)22-17(15-6-4-11-24-15)20-21-18(22)25-12-16(19)23/h4,6-11H,2-3,5,12H2,1H3,(H2,19,23)