6-ethoxy-3-[[(1-phenethyl-1,2,3,4-tetrazol-5-yl)methyl-(thiophen-2-ylmethyl)amino]methyl]-1H-quinolin-2-one

Systemtic Name: 6-ethoxy-3-[[(1-phenethyl-1,2,3,4-tetrazol-5-yl)methyl-(thiophen-2-ylmethyl)amino]methyl]-1H-quinolin-2-one Openeye Name: 6-ethoxy-3-[[(1-phenethyltetrazol-5-yl)methyl-(2-thienylmethyl)amino]methyl]-1H-quinolin-2-one CAS Name: 6-ethoxy-3-[[(1-phenethyl-5-tetrazolyl)methyl-(thiophen-2-ylmethyl)amino]methyl]-1H-quinolin-2-one IUPAC Name: 6-ethoxy-3-[[(1-phenethyltetrazol-5-yl)methyl-(thiophen-2-ylmethyl)amino]methyl]-1H-quinolin-2-one Traditional Name: 6-ethoxy-3-[[(1-phenethyltetrazol-5-yl)methyl-(2-thenyl)amino]methyl]carbostyril Formula: C27H28N6O2S MolecularWeight: 500.61522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CS3)CC4=NN=NN4CCC5=CC=CC=C5

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CS3)CC4=NN=NN4CCC5=CC=CC=C5

InChI

InChI=1S/C27H28N6O2S/c1-2-35-23-10-11-25-21(16-23)15-22(27(34)28-25)17-32(18-24-9-6-14-36-24)19-26-29-30-31-33(26)13-12-20-7-4-3-5-8-20/h3-11,14-16H,2,12-13,17-19H2,1H3,(H,28,34)