3-[[(4-fluorophenyl)methyl-[(1S)-1-[1-(2-methylbutan-2-yl)-1,2,3,4-tetrazol-5-yl]propyl]amino]methyl]-5,7-dimethyl-1H-quinolin-2-one

Systemtic Name: 3-[[(4-fluorophenyl)methyl-[(1S)-1-[1-(2-methylbutan-2-yl)-1,2,3,4-tetrazol-5-yl]propyl]amino]methyl]-5,7-dimethyl-1H-quinolin-2-one Openeye Name: 3-[[[(1S)-1-[1-(1,1-dimethylpropyl)tetrazol-5-yl]propyl]-[(4-fluorophenyl)methyl]amino]methyl]-5,7-dimethyl-1H-quinolin-2-one CAS Name: 3-[[(4-fluorophenyl)methyl-[(1S)-1-[1-(2-methylbutan-2-yl)-5-tetrazolyl]propyl]amino]methyl]-5,7-dimethyl-1H-quinolin-2-one IUPAC Name: 3-[[(4-fluorophenyl)methyl-[(1S)-1-[1-(2-methylbutan-2-yl)tetrazol-5-yl]propyl]amino]methyl]-5,7-dimethyl-1H-quinolin-2-one Traditional Name: 3-[[[(1S)-1-(1-tert-amyltetrazol-5-yl)propyl]-(4-fluorobenzyl)amino]methyl]-5,7-dimethyl-carbostyril Formula: C28H35FN6O MolecularWeight: 490.615503

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NN=NN1C(C)(C)CC)N(CC2=CC=C(C=C2)F)CC3=CC4=C(C=C(C=C4NC3=O)C)C

Isomeric SMILES

CC[C@@H](C1=NN=NN1C(C)(C)CC)N(CC2=CC=C(C=C2)F)CC3=CC4=C(C=C(C=C4NC3=O)C)C

InChI

InChI=1S/C28H35FN6O/c1-7-25(26-31-32-33-35(26)28(5,6)8-2)34(16-20-9-11-22(29)12-10-20)17-21-15-23-19(4)13-18(3)14-24(23)30-27(21)36/h9-15,25H,7-8,16-17H2,1-6H3,(H,30,36)/t25-/m0/s1