methyl 4-[4-aminocarbonyl-2-butyl-1-[2-(1H-imidazol-5-yl)ethyl]-5-methyl-pyrrol-3-yl]benzoate

Systemtic Name: methyl 4-[4-aminocarbonyl-2-butyl-1-[2-(1H-imidazol-5-yl)ethyl]-5-methyl-pyrrol-3-yl]benzoate Openeye Name: methyl 4-[2-butyl-4-carbamoyl-1-[2-(1H-imidazol-5-yl)ethyl]-5-methyl-pyrrol-3-yl]benzoate CAS Name: 4-[2-butyl-4-carbamoyl-1-[2-(1H-imidazol-5-yl)ethyl]-5-methyl-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-butyl-4-carbamoyl-1-[2-(1H-imidazol-5-yl)ethyl]-5-methylpyrrol-3-yl]benzoate Traditional Name: 4-[2-butyl-4-carbamoyl-1-[2-(1H-imidazol-5-yl)ethyl]-5-methyl-pyrrol-3-yl]benzoic acid methyl ester Formula: C23H28N4O3 MolecularWeight: 408.49342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCC2=CN=CN2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCC1=C(C(=C(N1CCC2=CN=CN2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H28N4O3/c1-4-5-6-19-21(16-7-9-17(10-8-16)23(29)30-3)20(22(24)28)15(2)27(19)12-11-18-13-25-14-26-18/h7-10,13-14H,4-6,11-12H2,1-3H3,(H2,24,28)(H,25,26)