(1-propyl-1,2,3,4-tetrazol-5-yl)methyl 2-thiophen-2-ylquinoline-4-carboxylate

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl 2-thiophen-2-ylquinoline-4-carboxylate Openeye Name: (1-propyltetrazol-5-yl)methyl 2-(2-thienyl)quinoline-4-carboxylate CAS Name: 2-thiophen-2-yl-4-quinolinecarboxylic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl 2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 2-(2-thienyl)cinchoninic acid (1-propyltetrazol-5-yl)methyl ester Formula: C19H17N5O2S MolecularWeight: 379.43558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C19H17N5O2S/c1-2-9-24-18(21-22-23-24)12-26-19(25)14-11-16(17-8-5-10-27-17)20-15-7-4-3-6-13(14)15/h3-8,10-11H,2,9,12H2,1H3