N-[4-[2-(4-tert-butylphenyl)ethyl]-6-methylsulfanyl-1,3,5-triazin-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[4-[2-(4-tert-butylphenyl)ethyl]-6-methylsulfanyl-1,3,5-triazin-2-yl]thiophene-2-carboxamide Openeye Name: N-[4-[2-(4-tert-butylphenyl)ethyl]-6-methylsulfanyl-1,3,5-triazin-2-yl]thiophene-2-carboxamide CAS Name: N-[4-[2-(4-tert-butylphenyl)ethyl]-6-(methylthio)-1,3,5-triazin-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[4-[2-(4-tert-butylphenyl)ethyl]-6-methylsulfanyl-1,3,5-triazin-2-yl]thiophene-2-carboxamide Traditional Name: N-[4-[2-(4-tert-butylphenyl)ethyl]-6-(methylthio)-s-triazin-2-yl]thiophene-2-carboxamide Formula: C21H24N4OS2 MolecularWeight: 412.57146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CCC2=NC(=NC(=N2)SC)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CCC2=NC(=NC(=N2)SC)NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H24N4OS2/c1-21(2,3)15-10-7-14(8-11-15)9-12-17-22-19(25-20(23-17)27-4)24-18(26)16-6-5-13-28-16/h5-8,10-11,13H,9,12H2,1-4H3,(H,22,23,24,25,26)