3-[[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl-(pyridin-3-ylmethyl)amino]methyl]-8-methyl-1H-quinolin-2-one

Systemtic Name: 3-[[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl-(pyridin-3-ylmethyl)amino]methyl]-8-methyl-1H-quinolin-2-one Openeye Name: 3-[[(1-cyclohexyltetrazol-5-yl)methyl-(3-pyridylmethyl)amino]methyl]-8-methyl-1H-quinolin-2-one CAS Name: 3-[[(1-cyclohexyl-5-tetrazolyl)methyl-(3-pyridinylmethyl)amino]methyl]-8-methyl-1H-quinolin-2-one IUPAC Name: 3-[[(1-cyclohexyltetrazol-5-yl)methyl-(pyridin-3-ylmethyl)amino]methyl]-8-methyl-1H-quinolin-2-one Traditional Name: 3-[[(1-cyclohexyltetrazol-5-yl)methyl-(3-pyridylmethyl)amino]methyl]-8-methyl-carbostyril Formula: C25H29N7O MolecularWeight: 443.54406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3=CN=CC=C3)CC4=NN=NN4C5CCCCC5

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3=CN=CC=C3)CC4=NN=NN4C5CCCCC5

InChI

InChI=1S/C25H29N7O/c1-18-7-5-9-20-13-21(25(33)27-24(18)20)16-31(15-19-8-6-12-26-14-19)17-23-28-29-30-32(23)22-10-3-2-4-11-22/h5-9,12-14,22H,2-4,10-11,15-17H2,1H3,(H,27,33)