3-[[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl-phenethyl-amino]methyl]-5,7-dimethyl-1H-quinolin-2-one

Systemtic Name: 3-[[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl-phenethyl-amino]methyl]-5,7-dimethyl-1H-quinolin-2-one Openeye Name: 3-[[(1-tert-butyltetrazol-5-yl)methyl-phenethyl-amino]methyl]-5,7-dimethyl-1H-quinolin-2-one CAS Name: 3-[[(1-tert-butyl-5-tetrazolyl)methyl-phenethylamino]methyl]-5,7-dimethyl-1H-quinolin-2-one IUPAC Name: 3-[[(1-tert-butyltetrazol-5-yl)methyl-phenethylamino]methyl]-5,7-dimethyl-1H-quinolin-2-one Traditional Name: 3-[[(1-tert-butyltetrazol-5-yl)methyl-phenethyl-amino]methyl]-5,7-dimethyl-carbostyril Formula: C26H32N6O MolecularWeight: 444.57188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CCC3=CC=CC=C3)CC4=NN=NN4C(C)(C)C)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CCC3=CC=CC=C3)CC4=NN=NN4C(C)(C)C)C

InChI

InChI=1S/C26H32N6O/c1-18-13-19(2)22-15-21(25(33)27-23(22)14-18)16-31(12-11-20-9-7-6-8-10-20)17-24-28-29-30-32(24)26(3,4)5/h6-10,13-15H,11-12,16-17H2,1-5H3,(H,27,33)