ethyl 2-[[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]carbamoyl-(pyridin-2-ylmethyl)amino]ethanoate

Systemtic Name: ethyl 2-[[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]carbamoyl-(pyridin-2-ylmethyl)amino]ethanoate Openeye Name: ethyl 2-[(2,6-dibromo-4-isopropyl-phenyl)carbamoyl-(2-pyridylmethyl)amino]acetate CAS Name: 2-[[(2,6-dibromo-4-propan-2-ylanilino)-oxomethyl]-(2-pyridinylmethyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2,6-dibromo-4-propan-2-ylphenyl)carbamoyl-(pyridin-2-ylmethyl)amino]acetate Traditional Name: 2-[(2,6-dibromo-4-isopropyl-phenyl)carbamoyl-(2-pyridylmethyl)amino]acetic acid ethyl ester Formula: C20H23Br2N3O3 MolecularWeight: 513.22292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC1=CC=CC=N1)C(=O)NC2=C(C=C(C=C2Br)C(C)C)Br

Isomeric SMILES

CCOC(=O)CN(CC1=CC=CC=N1)C(=O)NC2=C(C=C(C=C2Br)C(C)C)Br

InChI

InChI=1S/C20H23Br2N3O3/c1-4-28-18(26)12-25(11-15-7-5-6-8-23-15)20(27)24-19-16(21)9-14(13(2)3)10-17(19)22/h5-10,13H,4,11-12H2,1-3H3,(H,24,27)