N-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]thiophene-2-carboxamide Openeye Name: N-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]thiophene-2-carboxamide CAS Name: N-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]thiophene-2-carboxamide Traditional Name: N-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetyl]thiophene-2-carboxamide Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H22N4O2S2/c1-20(2,3)14-9-7-13(8-10-14)17-22-23-19(24(17)4)28-12-16(25)21-18(26)15-6-5-11-27-15/h5-11H,12H2,1-4H3,(H,21,25,26)