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

Systemtic Name: 3-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-(4-cyclohexylpiperazin-1-yl)methyl]-6-methyl-1H-quinolin-2-one Openeye Name: 3-[(1-tert-butyltetrazol-5-yl)-(4-cyclohexylpiperazin-1-yl)methyl]-6-methyl-1H-quinolin-2-one CAS Name: 3-[(1-tert-butyl-5-tetrazolyl)-(4-cyclohexyl-1-piperazinyl)methyl]-6-methyl-1H-quinolin-2-one IUPAC Name: 3-[(1-tert-butyltetrazol-5-yl)-(4-cyclohexylpiperazin-1-yl)methyl]-6-methyl-1H-quinolin-2-one Traditional Name: 3-[(1-tert-butyltetrazol-5-yl)-(4-cyclohexylpiperazino)methyl]-6-methyl-carbostyril Formula: C26H37N7O MolecularWeight: 463.61828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3C(C)(C)C)N4CCN(CC4)C5CCCCC5

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)C(C3=NN=NN3C(C)(C)C)N4CCN(CC4)C5CCCCC5

InChI

InChI=1S/C26H37N7O/c1-18-10-11-22-19(16-18)17-21(25(34)27-22)23(24-28-29-30-33(24)26(2,3)4)32-14-12-31(13-15-32)20-8-6-5-7-9-20/h10-11,16-17,20,23H,5-9,12-15H2,1-4H3,(H,27,34)