ethyl 2-[[1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-[(5-phenyl-1H-pyrrol-2-yl)carbonyl]amino]ethanoate

Systemtic Name: ethyl 2-[[1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-[(5-phenyl-1H-pyrrol-2-yl)carbonyl]amino]ethanoate Openeye Name: ethyl 2-[[2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]-(5-phenyl-1H-pyrrole-2-carbonyl)amino]acetate CAS Name: 2-[[1-(cyclohexylamino)-1-oxopropan-2-yl]-[oxo-(5-phenyl-1H-pyrrol-2-yl)methyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[1-(cyclohexylamino)-1-oxopropan-2-yl]-(5-phenyl-1H-pyrrole-2-carbonyl)amino]acetate Traditional Name: 2-[[2-(cyclohexylamino)-2-keto-1-methyl-ethyl]-(5-phenyl-1H-pyrrole-2-carbonyl)amino]acetic acid ethyl ester Formula: C24H31N3O4 MolecularWeight: 425.52064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C(C)C(=O)NC1CCCCC1)C(=O)C2=CC=C(N2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN(C(C)C(=O)NC1CCCCC1)C(=O)C2=CC=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C24H31N3O4/c1-3-31-22(28)16-27(17(2)23(29)25-19-12-8-5-9-13-19)24(30)21-15-14-20(26-21)18-10-6-4-7-11-18/h4,6-7,10-11,14-15,17,19,26H,3,5,8-9,12-13,16H2,1-2H3,(H,25,29)