ethyl 7-[(2-butyl-7-methoxycarbonyl-benzimidazol-1-yl)methyl]-2-phenyl-imidazo[1,2-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 7-[(2-butyl-7-methoxycarbonyl-benzimidazol-1-yl)methyl]-2-phenyl-imidazo[1,2-a]pyrimidine-3-carboxylate Openeye Name: ethyl 7-[(2-butyl-7-methoxycarbonyl-benzimidazol-1-yl)methyl]-2-phenyl-imidazo[1,2-a]pyrimidine-3-carboxylate CAS Name: 7-[(2-butyl-7-methoxycarbonyl-1-benzimidazolyl)methyl]-2-phenyl-3-imidazo[1,2-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-[(2-butyl-7-methoxycarbonylbenzimidazol-1-yl)methyl]-2-phenylimidazo[1,2-a]pyrimidine-3-carboxylate Traditional Name: 7-[(2-butyl-7-carbomethoxy-benzimidazol-1-yl)methyl]-2-phenyl-imidazo[1,2-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C29H29N5O4 MolecularWeight: 511.57166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC(=C2N1CC3=NC4=NC(=C(N4C=C3)C(=O)OCC)C5=CC=CC=C5)C(=O)OC

Isomeric SMILES

CCCCC1=NC2=CC=CC(=C2N1CC3=NC4=NC(=C(N4C=C3)C(=O)OCC)C5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C29H29N5O4/c1-4-6-15-23-31-22-14-10-13-21(27(35)37-3)25(22)34(23)18-20-16-17-33-26(28(36)38-5-2)24(32-29(33)30-20)19-11-8-7-9-12-19/h7-14,16-17H,4-6,15,18H2,1-3H3