3-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-5,8-dimethyl-1H-quinolin-2-one

Systemtic Name: 3-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-5,8-dimethyl-1H-quinolin-2-one Openeye Name: 3-[(1-cyclohexyltetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-5,8-dimethyl-1H-quinolin-2-one CAS Name: 3-[(1-cyclohexyl-5-tetrazolyl)-(4-phenyl-1-piperazinyl)methyl]-5,8-dimethyl-1H-quinolin-2-one IUPAC Name: 3-[(1-cyclohexyltetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-5,8-dimethyl-1H-quinolin-2-one Traditional Name: 3-[(1-cyclohexyltetrazol-5-yl)-(4-phenylpiperazino)methyl]-5,8-dimethyl-carbostyril Formula: C29H35N7O MolecularWeight: 497.6345

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)C(C3=NN=NN3C4CCCCC4)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)C(C3=NN=NN3C4CCCCC4)N5CCN(CC5)C6=CC=CC=C6

InChI

InChI=1S/C29H35N7O/c1-20-13-14-21(2)26-24(20)19-25(29(37)30-26)27(28-31-32-33-36(28)23-11-7-4-8-12-23)35-17-15-34(16-18-35)22-9-5-3-6-10-22/h3,5-6,9-10,13-14,19,23,27H,4,7-8,11-12,15-18H2,1-2H3,(H,30,37)