3-[[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl-(pyridin-3-ylmethyl)amino]methyl]-6-methoxy-1H-quinolin-2-one

Systemtic Name: 3-[[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl-(pyridin-3-ylmethyl)amino]methyl]-6-methoxy-1H-quinolin-2-one Openeye Name: 3-[[(1-cyclohexyltetrazol-5-yl)methyl-(3-pyridylmethyl)amino]methyl]-6-methoxy-1H-quinolin-2-one CAS Name: 3-[[(1-cyclohexyl-5-tetrazolyl)methyl-(3-pyridinylmethyl)amino]methyl]-6-methoxy-1H-quinolin-2-one IUPAC Name: 3-[[(1-cyclohexyltetrazol-5-yl)methyl-(pyridin-3-ylmethyl)amino]methyl]-6-methoxy-1H-quinolin-2-one Traditional Name: 3-[[(1-cyclohexyltetrazol-5-yl)methyl-(3-pyridylmethyl)amino]methyl]-6-methoxy-carbostyril Formula: C25H29N7O2 MolecularWeight: 459.54346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CN=CC=C3)CC4=NN=NN4C5CCCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CN=CC=C3)CC4=NN=NN4C5CCCCC5

InChI

InChI=1S/C25H29N7O2/c1-34-22-9-10-23-19(13-22)12-20(25(33)27-23)16-31(15-18-6-5-11-26-14-18)17-24-28-29-30-32(24)21-7-3-2-4-8-21/h5-6,9-14,21H,2-4,7-8,15-17H2,1H3,(H,27,33)