6-azanyl-7-methyl-2-[[5-methyl-1-(triphenylmethyl)imidazol-4-yl]methyl]isoquinolin-1-one

Systemtic Name: 6-azanyl-7-methyl-2-[[5-methyl-1-(triphenylmethyl)imidazol-4-yl]methyl]isoquinolin-1-one Openeye Name: 6-amino-7-methyl-2-[(5-methyl-1-trityl-imidazol-4-yl)methyl]isoquinolin-1-one CAS Name: 6-amino-7-methyl-2-[[5-methyl-1-(triphenylmethyl)-4-imidazolyl]methyl]-1-isoquinolinone IUPAC Name: 6-amino-7-methyl-2-[(5-methyl-1-tritylimidazol-4-yl)methyl]isoquinolin-1-one Traditional Name: 6-amino-7-methyl-2-[(5-methyl-1-trityl-imidazol-4-yl)methyl]isocarbostyril Formula: C34H30N4O MolecularWeight: 510.6282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CN(C(=O)C2=C1)CC3=C(N(C=N3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C)N

Isomeric SMILES

CC1=C(C=C2C=CN(C(=O)C2=C1)CC3=C(N(C=N3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C)N

InChI

InChI=1S/C34H30N4O/c1-24-20-30-26(21-31(24)35)18-19-37(33(30)39)22-32-25(2)38(23-36-32)34(27-12-6-3-7-13-27,28-14-8-4-9-15-28)29-16-10-5-11-17-29/h3-21,23H,22,35H2,1-2H3