N-[1-[4-methyl-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]thiophene-2-carboxamide

Systemtic Name: N-[1-[4-methyl-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]thiophene-2-carboxamide Openeye Name: N-[1-[4-methyl-5-(o-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]thiophene-2-carboxamide CAS Name: N-[1-[4-methyl-5-[(2-methylphenyl)methylthio]-1,2,4-triazol-3-yl]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[1-[4-methyl-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]thiophene-2-carboxamide Traditional Name: N-[1-[4-methyl-5-[(2-methylbenzyl)thio]-1,2,4-triazol-3-yl]ethyl]thiophene-2-carboxamide Formula: C18H20N4OS2 MolecularWeight: 372.5076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2C)C(C)NC(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2C)C(C)NC(=O)C3=CC=CS3

InChI

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