5,7-dimethyl-3-[(1-phenethyl-1,2,3,4-tetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-1H-quinolin-2-one

Systemtic Name: 5,7-dimethyl-3-[(1-phenethyl-1,2,3,4-tetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-1H-quinolin-2-one Openeye Name: 5,7-dimethyl-3-[(1-phenethyltetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-1H-quinolin-2-one CAS Name: 5,7-dimethyl-3-[(1-phenethyl-5-tetrazolyl)-(4-phenyl-1-piperazinyl)methyl]-1H-quinolin-2-one IUPAC Name: 5,7-dimethyl-3-[(1-phenethyltetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-1H-quinolin-2-one Traditional Name: 5,7-dimethyl-3-[(1-phenethyltetrazol-5-yl)-(4-phenylpiperazino)methyl]carbostyril Formula: C31H33N7O MolecularWeight: 519.64002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)C(C3=NN=NN3CCC4=CC=CC=C4)N5CCN(CC5)C6=CC=CC=C6)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)C(C3=NN=NN3CCC4=CC=CC=C4)N5CCN(CC5)C6=CC=CC=C6)C

InChI

InChI=1S/C31H33N7O/c1-22-19-23(2)26-21-27(31(39)32-28(26)20-22)29(37-17-15-36(16-18-37)25-11-7-4-8-12-25)30-33-34-35-38(30)14-13-24-9-5-3-6-10-24/h3-12,19-21,29H,13-18H2,1-2H3,(H,32,39)