ethyl 8-cyano-7-(4-methoxyphenyl)-6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]-4-oxidanylidene-1-(phenylmethyl)pyrrolo[1,2-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 8-cyano-7-(4-methoxyphenyl)-6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]-4-oxidanylidene-1-(phenylmethyl)pyrrolo[1,2-a]pyrimidine-3-carboxylate Openeye Name: ethyl 1-benzyl-8-cyano-7-(4-methoxyphenyl)-6-[[methyl-[2-(2-pyridyl)ethyl]amino]methyl]-4-oxo-pyrrolo[1,2-a]pyrimidine-3-carboxylate CAS Name: 8-cyano-7-(4-methoxyphenyl)-6-[[methyl-[2-(2-pyridinyl)ethyl]amino]methyl]-4-oxo-1-(phenylmethyl)-3-pyrrolo[1,2-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-8-cyano-7-(4-methoxyphenyl)-6-[[methyl(2-pyridin-2-ylethyl)amino]methyl]-4-oxopyrrolo[1,2-a]pyrimidine-3-carboxylate Traditional Name: 1-benzyl-8-cyano-4-keto-7-(4-methoxyphenyl)-6-[[methyl-[2-(2-pyridyl)ethyl]amino]methyl]pyrrolo[1,2-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C34H33N5O4 MolecularWeight: 575.65692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=C(N2C1=O)CN(C)CCC3=CC=CC=N3)C4=CC=C(C=C4)OC)C#N)CC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(N2C1=O)CN(C)CCC3=CC=CC=N3)C4=CC=C(C=C4)OC)C#N)CC5=CC=CC=C5

InChI

InChI=1S/C34H33N5O4/c1-4-43-34(41)29-22-38(21-24-10-6-5-7-11-24)32-28(20-35)31(25-13-15-27(42-3)16-14-25)30(39(32)33(29)40)23-37(2)19-17-26-12-8-9-18-36-26/h5-16,18,22H,4,17,19,21,23H2,1-3H3