ethyl 4-[[2-(cyclohexylamino)-1-(4-hydroxyphenyl)-2-oxidanylidene-ethyl]-pyrazin-2-ylcarbonyl-amino]benzoate

Systemtic Name: ethyl 4-[[2-(cyclohexylamino)-1-(4-hydroxyphenyl)-2-oxidanylidene-ethyl]-pyrazin-2-ylcarbonyl-amino]benzoate Openeye Name: ethyl 4-[[2-(cyclohexylamino)-1-(4-hydroxyphenyl)-2-oxo-ethyl]-(pyrazine-2-carbonyl)amino]benzoate CAS Name: 4-[[2-(cyclohexylamino)-1-(4-hydroxyphenyl)-2-oxoethyl]-[oxo(2-pyrazinyl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(cyclohexylamino)-1-(4-hydroxyphenyl)-2-oxoethyl]-(pyrazine-2-carbonyl)amino]benzoate Traditional Name: 4-[[2-(cyclohexylamino)-1-(4-hydroxyphenyl)-2-keto-ethyl]-pyrazinoyl-amino]benzoic acid ethyl ester Formula: C28H30N4O5 MolecularWeight: 502.5616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N(C(C2=CC=C(C=C2)O)C(=O)NC3CCCCC3)C(=O)C4=NC=CN=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N(C(C2=CC=C(C=C2)O)C(=O)NC3CCCCC3)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C28H30N4O5/c1-2-37-28(36)20-8-12-22(13-9-20)32(27(35)24-18-29-16-17-30-24)25(19-10-14-23(33)15-11-19)26(34)31-21-6-4-3-5-7-21/h8-18,21,25,33H,2-7H2,1H3,(H,31,34)