ethyl 4-[4-[(1-phenylbenzimidazol-5-yl)amino]phthalazin-1-yl]benzoate

Systemtic Name: ethyl 4-[4-[(1-phenylbenzimidazol-5-yl)amino]phthalazin-1-yl]benzoate Openeye Name: ethyl 4-[4-[(1-phenylbenzimidazol-5-yl)amino]phthalazin-1-yl]benzoate CAS Name: 4-[4-[(1-phenyl-5-benzimidazolyl)amino]-1-phthalazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(1-phenylbenzimidazol-5-yl)amino]phthalazin-1-yl]benzoate Traditional Name: 4-[4-[(1-phenylbenzimidazol-5-yl)amino]phthalazin-1-yl]benzoic acid ethyl ester Formula: C30H23N5O2 MolecularWeight: 485.53592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC5=C(C=C4)N(C=N5)C6=CC=CC=C6

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC5=C(C=C4)N(C=N5)C6=CC=CC=C6

InChI

InChI=1S/C30H23N5O2/c1-2-37-30(36)21-14-12-20(13-15-21)28-24-10-6-7-11-25(24)29(34-33-28)32-22-16-17-27-26(18-22)31-19-35(27)23-8-4-3-5-9-23/h3-19H,2H2,1H3,(H,32,34)