2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylsulfonylphenyl)ethanamide Openeye Name: 2-[[4-allyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylsulfonylphenyl)acetamide CAS Name: 2-[[5-(2-furanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-N-(3-methylsulfonylphenyl)acetamide IUPAC Name: 2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylsulfonylphenyl)acetamide Traditional Name: 2-[[4-allyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]-N-(3-mesylphenyl)acetamide Formula: C18H18N4O4S2 MolecularWeight: 418.48992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=CO3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=CO3

InChI

InChI=1S/C18H18N4O4S2/c1-3-9-22-17(15-8-5-10-26-15)20-21-18(22)27-12-16(23)19-13-6-4-7-14(11-13)28(2,24)25/h3-8,10-11H,1,9,12H2,2H3,(H,19,23)