N-(furan-2-ylmethyl)-4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanamide

Systemtic Name: N-(furan-2-ylmethyl)-4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanamide Openeye Name: N-(2-furylmethyl)-4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanamide CAS Name: N-(2-furanylmethyl)-4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]butanamide IUPAC Name: N-(furan-2-ylmethyl)-4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]butanamide Traditional Name: N-(2-furfuryl)-4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]butyramide Formula: C18H20N4O2S MolecularWeight: 356.442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SCCCC(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SCCCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C18H20N4O2S/c1-14-20-21-18(22(14)15-7-3-2-4-8-15)25-12-6-10-17(23)19-13-16-9-5-11-24-16/h2-5,7-9,11H,6,10,12-13H2,1H3,(H,19,23)