methyl 3-[8-azanyl-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylate

Systemtic Name: methyl 3-[8-azanyl-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylate Openeye Name: methyl 3-[8-amino-1-(3-benzyloxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexanecarboxylate CAS Name: 3-[8-amino-1-(3-phenylmethoxyphenyl)-3-imidazo[1,5-a]pyrazinyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 3-[8-amino-1-(3-phenylmethoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexane-1-carboxylate Traditional Name: 3-[8-amino-1-(3-benzoxyphenyl)imidazo[1,5-a]pyrazin-3-yl]cyclohexanecarboxylic acid methyl ester Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCC(C1)C2=NC(=C3N2C=CN=C3N)C4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

COC(=O)C1CCCC(C1)C2=NC(=C3N2C=CN=C3N)C4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C27H28N4O3/c1-33-27(32)21-11-5-10-20(15-21)26-30-23(24-25(28)29-13-14-31(24)26)19-9-6-12-22(16-19)34-17-18-7-3-2-4-8-18/h2-4,6-9,12-14,16,20-21H,5,10-11,15,17H2,1H3,(H2,28,29)