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

Systemtic Name: 3-[[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl-cyclopentyl-amino]methyl]-6-methyl-1H-quinolin-2-one Openeye Name: 3-[[(1-tert-butyltetrazol-5-yl)methyl-cyclopentyl-amino]methyl]-6-methyl-1H-quinolin-2-one CAS Name: 3-[[(1-tert-butyl-5-tetrazolyl)methyl-cyclopentylamino]methyl]-6-methyl-1H-quinolin-2-one IUPAC Name: 3-[[(1-tert-butyltetrazol-5-yl)methyl-cyclopentylamino]methyl]-6-methyl-1H-quinolin-2-one Traditional Name: 3-[[(1-tert-butyltetrazol-5-yl)methyl-cyclopentyl-amino]methyl]-6-methyl-carbostyril Formula: C22H30N6O MolecularWeight: 394.5132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=NN=NN3C(C)(C)C)C4CCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=NN=NN3C(C)(C)C)C4CCCC4

InChI

InChI=1S/C22H30N6O/c1-15-9-10-19-16(11-15)12-17(21(29)23-19)13-27(18-7-5-6-8-18)14-20-24-25-26-28(20)22(2,3)4/h9-12,18H,5-8,13-14H2,1-4H3,(H,23,29)