3-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-(4-ethylpiperazin-1-yl)methyl]-8-methyl-1H-quinolin-2-one

Systemtic Name: 3-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-(4-ethylpiperazin-1-yl)methyl]-8-methyl-1H-quinolin-2-one Openeye Name: 3-[(1-tert-butyltetrazol-5-yl)-(4-ethylpiperazin-1-yl)methyl]-8-methyl-1H-quinolin-2-one CAS Name: 3-[(1-tert-butyl-5-tetrazolyl)-(4-ethyl-1-piperazinyl)methyl]-8-methyl-1H-quinolin-2-one IUPAC Name: 3-[(1-tert-butyltetrazol-5-yl)-(4-ethylpiperazin-1-yl)methyl]-8-methyl-1H-quinolin-2-one Traditional Name: 3-[(1-tert-butyltetrazol-5-yl)-(4-ethylpiperazino)methyl]-8-methyl-carbostyril Formula: C22H31N7O MolecularWeight: 409.52784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(C2=CC3=C(C(=CC=C3)C)NC2=O)C4=NN=NN4C(C)(C)C

Isomeric SMILES

CCN1CCN(CC1)C(C2=CC3=C(C(=CC=C3)C)NC2=O)C4=NN=NN4C(C)(C)C

InChI

InChI=1S/C22H31N7O/c1-6-27-10-12-28(13-11-27)19(20-24-25-26-29(20)22(3,4)5)17-14-16-9-7-8-15(2)18(16)23-21(17)30/h7-9,14,19H,6,10-13H2,1-5H3,(H,23,30)