8-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-5-chloranyl-quinoline

Systemtic Name: 8-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-5-chloranyl-quinoline Openeye Name: 8-[(1-tert-butyltetrazol-5-yl)sulfanylmethyl]-5-chloro-quinoline CAS Name: 8-[[(1-tert-butyl-5-tetrazolyl)thio]methyl]-5-chloroquinoline IUPAC Name: 8-[(1-tert-butyltetrazol-5-yl)sulfanylmethyl]-5-chloroquinoline Traditional Name: 8-[[(1-tert-butyltetrazol-5-yl)thio]methyl]-5-chloro-quinoline Formula: C15H16ClN5S MolecularWeight: 333.83904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=N1)SCC2=C3C(=C(C=C2)Cl)C=CC=N3

Isomeric SMILES

CC(C)(C)N1C(=NN=N1)SCC2=C3C(=C(C=C2)Cl)C=CC=N3

InChI

InChI=1S/C15H16ClN5S/c1-15(2,3)21-14(18-19-20-21)22-9-10-6-7-12(16)11-5-4-8-17-13(10)11/h4-8H,9H2,1-3H3