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

Systemtic Name: 5,8-dimethyl-3-[(1-phenethyl-1,2,3,4-tetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-1H-quinolin-2-one Openeye Name: 5,8-dimethyl-3-[(1-phenethyltetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-1H-quinolin-2-one CAS Name: 5,8-dimethyl-3-[(1-phenethyl-5-tetrazolyl)-(4-phenyl-1-piperazinyl)methyl]-1H-quinolin-2-one IUPAC Name: 5,8-dimethyl-3-[(1-phenethyltetrazol-5-yl)-(4-phenylpiperazin-1-yl)methyl]-1H-quinolin-2-one Traditional Name: 5,8-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=C2C=C(C(=O)NC2=C(C=C1)C)C(C3=NN=NN3CCC4=CC=CC=C4)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

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

InChI

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