5-(5-ethylsulfanyl-1,2,3,4-tetrazol-2-yl)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: 5-(5-ethylsulfanyl-1,2,3,4-tetrazol-2-yl)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-5-(5-ethylsulfanyltetrazol-2-yl)-4-oxo-pentanoic acid CAS Name: 5-[5-(ethylthio)-2-tetrazolyl]-4-oxo-3-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: 5-(5-ethylsulfanyltetrazol-2-yl)-4-oxo-3-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: 3-(benzyloxycarbonylamino)-5-[5-(ethylthio)tetrazol-2-yl]-4-keto-valeric acid Formula: C16H19N5O5S MolecularWeight: 393.41756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN(N=N1)CC(=O)C(CC(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCSC1=NN(N=N1)CC(=O)C(CC(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H19N5O5S/c1-2-27-15-18-20-21(19-15)9-13(22)12(8-14(23)24)17-16(25)26-10-11-6-4-3-5-7-11/h3-7,12H,2,8-10H2,1H3,(H,17,25)(H,23,24)