ethyl 4-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoylamino]butanoate Openeye Name: ethyl 4-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]butanoate CAS Name: 4-[[1-oxo-2-[(1-phenyl-5-tetrazolyl)thio]ethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]butanoate Traditional Name: 4-[[2-[(1-phenyltetrazol-5-yl)thio]acetyl]amino]butyric acid ethyl ester Formula: C15H19N5O3S MolecularWeight: 349.40806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CSC1=NN=NN1C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CCCNC(=O)CSC1=NN=NN1C2=CC=CC=C2

InChI

InChI=1S/C15H19N5O3S/c1-2-23-14(22)9-6-10-16-13(21)11-24-15-17-18-19-20(15)12-7-4-3-5-8-12/h3-5,7-8H,2,6,9-11H2,1H3,(H,16,21)