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

Systemtic Name: 3-[[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)methyl-(pyridin-3-ylmethyl)amino]methyl]-6-ethyl-1H-quinolin-2-one Openeye Name: 3-[[(1-cyclopentyltetrazol-5-yl)methyl-(3-pyridylmethyl)amino]methyl]-6-ethyl-1H-quinolin-2-one CAS Name: 3-[[(1-cyclopentyl-5-tetrazolyl)methyl-(3-pyridinylmethyl)amino]methyl]-6-ethyl-1H-quinolin-2-one IUPAC Name: 3-[[(1-cyclopentyltetrazol-5-yl)methyl-(pyridin-3-ylmethyl)amino]methyl]-6-ethyl-1H-quinolin-2-one Traditional Name: 3-[[(1-cyclopentyltetrazol-5-yl)methyl-(3-pyridylmethyl)amino]methyl]-6-ethyl-carbostyril Formula: C25H29N7O MolecularWeight: 443.54406

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CN=CC=C3)CC4=NN=NN4C5CCCC5

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CN=CC=C3)CC4=NN=NN4C5CCCC5

InChI

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