N-[(3-methylthiophen-2-yl)methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-[(3-methylthiophen-2-yl)methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-[(3-methyl-2-thienyl)methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-[(3-methyl-2-thiophenyl)methyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-[(3-methylthiophen-2-yl)methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-[(3-methyl-2-thienyl)methyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C16H16N4OS2 MolecularWeight: 344.45444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CNC(=O)C2=CC=C(C=C2)CSC3=NC=NN3

Isomeric SMILES

CC1=C(SC=C1)CNC(=O)C2=CC=C(C=C2)CSC3=NC=NN3

InChI

InChI=1S/C16H16N4OS2/c1-11-6-7-22-14(11)8-17-15(21)13-4-2-12(3-5-13)9-23-16-18-10-19-20-16/h2-7,10H,8-9H2,1H3,(H,17,21)(H,18,19,20)