3-[3,4-dihydro-1H-isoquinolin-2-yl-(1-phenethyl-1,2,3,4-tetrazol-5-yl)methyl]-6,7-dimethyl-1H-quinolin-2-one

Systemtic Name: 3-[3,4-dihydro-1H-isoquinolin-2-yl-(1-phenethyl-1,2,3,4-tetrazol-5-yl)methyl]-6,7-dimethyl-1H-quinolin-2-one Openeye Name: 3-[3,4-dihydro-1H-isoquinolin-2-yl-(1-phenethyltetrazol-5-yl)methyl]-6,7-dimethyl-1H-quinolin-2-one CAS Name: 3-[3,4-dihydro-1H-isoquinolin-2-yl-(1-phenethyl-5-tetrazolyl)methyl]-6,7-dimethyl-1H-quinolin-2-one IUPAC Name: 3-[3,4-dihydro-1H-isoquinolin-2-yl-(1-phenethyltetrazol-5-yl)methyl]-6,7-dimethyl-1H-quinolin-2-one Traditional Name: 3-[3,4-dihydro-1H-isoquinolin-2-yl-(1-phenethyltetrazol-5-yl)methyl]-6,7-dimethyl-carbostyril Formula: C30H30N6O MolecularWeight: 490.5988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=O)N2)C(C3=NN=NN3CCC4=CC=CC=C4)N5CCC6=CC=CC=C6C5)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)C(C3=NN=NN3CCC4=CC=CC=C4)N5CCC6=CC=CC=C6C5)C

InChI

InChI=1S/C30H30N6O/c1-20-16-25-18-26(30(37)31-27(25)17-21(20)2)28(35-14-13-23-10-6-7-11-24(23)19-35)29-32-33-34-36(29)15-12-22-8-4-3-5-9-22/h3-11,16-18,28H,12-15,19H2,1-2H3,(H,31,37)