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

Systemtic Name: 5-methyl-N-[(5-methylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)methyl]thiophene-2-carboxamide Openeye Name: N-[(4-allyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-5-methyl-thiophene-2-carboxamide CAS Name: 5-methyl-N-[[5-(methylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-2-thiophenecarboxamide IUPAC Name: 5-methyl-N-[(5-methylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)methyl]thiophene-2-carboxamide Traditional Name: N-[[4-allyl-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-5-methyl-thiophene-2-carboxamide Formula: C13H16N4OS2 MolecularWeight: 308.42234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NCC2=NN=C(N2CC=C)SC

Isomeric SMILES

CC1=CC=C(S1)C(=O)NCC2=NN=C(N2CC=C)SC

InChI

InChI=1S/C13H16N4OS2/c1-4-7-17-11(15-16-13(17)19-3)8-14-12(18)10-6-5-9(2)20-10/h4-6H,1,7-8H2,2-3H3,(H,14,18)