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

Systemtic Name: 2-[[1-(furan-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-phenyl-butanamide Openeye Name: 2-[1-(2-furylmethyl)tetrazol-5-yl]sulfanyl-N-phenyl-butanamide CAS Name: 2-[[1-(2-furanylmethyl)-5-tetrazolyl]thio]-N-phenylbutanamide IUPAC Name: 2-[1-(furan-2-ylmethyl)tetrazol-5-yl]sulfanyl-N-phenylbutanamide Traditional Name: 2-[[1-(2-furfuryl)tetrazol-5-yl]thio]-N-phenyl-butyramide Formula: C16H17N5O2S MolecularWeight: 343.40348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)SC2=NN=NN2CC3=CC=CO3

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1)SC2=NN=NN2CC3=CC=CO3

InChI

InChI=1S/C16H17N5O2S/c1-2-14(15(22)17-12-7-4-3-5-8-12)24-16-18-19-20-21(16)11-13-9-6-10-23-13/h3-10,14H,2,11H2,1H3,(H,17,22)