3-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-(4-cyclohexylpiperazin-1-yl)methyl]-6,8-dimethyl-1H-quinolin-2-one

Systemtic Name: 3-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)-(4-cyclohexylpiperazin-1-yl)methyl]-6,8-dimethyl-1H-quinolin-2-one Openeye Name: 3-[(1-tert-butyltetrazol-5-yl)-(4-cyclohexylpiperazin-1-yl)methyl]-6,8-dimethyl-1H-quinolin-2-one CAS Name: 3-[(1-tert-butyl-5-tetrazolyl)-(4-cyclohexyl-1-piperazinyl)methyl]-6,8-dimethyl-1H-quinolin-2-one IUPAC Name: 3-[(1-tert-butyltetrazol-5-yl)-(4-cyclohexylpiperazin-1-yl)methyl]-6,8-dimethyl-1H-quinolin-2-one Traditional Name: 3-[(1-tert-butyltetrazol-5-yl)-(4-cyclohexylpiperazino)methyl]-6,8-dimethyl-carbostyril Formula: C27H39N7O MolecularWeight: 477.64486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C(=O)N2)C(C3=NN=NN3C(C)(C)C)N4CCN(CC4)C5CCCCC5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C(=O)N2)C(C3=NN=NN3C(C)(C)C)N4CCN(CC4)C5CCCCC5)C

InChI

InChI=1S/C27H39N7O/c1-18-15-19(2)23-20(16-18)17-22(26(35)28-23)24(25-29-30-31-34(25)27(3,4)5)33-13-11-32(12-14-33)21-9-7-6-8-10-21/h15-17,21,24H,6-14H2,1-5H3,(H,28,35)