2-[[4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[[4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)ethanamide Openeye Name: 2-[[4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(m-tolyl)acetamide CAS Name: 2-[[4-(2-furanylmethyl)-1,2,4-triazol-3-yl]thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[[4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)acetamide Traditional Name: 2-[[4-(2-furfuryl)-1,2,4-triazol-3-yl]thio]-N-(m-tolyl)acetamide Formula: C16H16N4O2S MolecularWeight: 328.38884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=NN=CN2CC3=CC=CO3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=NN=CN2CC3=CC=CO3

InChI

InChI=1S/C16H16N4O2S/c1-12-4-2-5-13(8-12)18-15(21)10-23-16-19-17-11-20(16)9-14-6-3-7-22-14/h2-8,11H,9-10H2,1H3,(H,18,21)