methyl 5-bromanyl-3-(2,4-dichlorophenyl)-6-[(2-oxidanyl-2,3-dihydro-1H-inden-1-yl)amino]pyrazine-2-carboxylate

Systemtic Name: methyl 5-bromanyl-3-(2,4-dichlorophenyl)-6-[(2-oxidanyl-2,3-dihydro-1H-inden-1-yl)amino]pyrazine-2-carboxylate Openeye Name: methyl 5-bromo-3-(2,4-dichlorophenyl)-6-[(2-hydroxyindan-1-yl)amino]pyrazine-2-carboxylate CAS Name: 5-bromo-3-(2,4-dichlorophenyl)-6-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-2-pyrazinecarboxylic acid methyl ester IUPAC Name: methyl 5-bromo-3-(2,4-dichlorophenyl)-6-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]pyrazine-2-carboxylate Traditional Name: 5-bromo-3-(2,4-dichlorophenyl)-6-[(2-hydroxyindan-1-yl)amino]pyrazinic acid methyl ester Formula: C21H16BrCl2N3O3 MolecularWeight: 509.18004

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N=C(C(=N1)NC2C(CC3=CC=CC=C23)O)Br)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

COC(=O)C1=C(N=C(C(=N1)NC2C(CC3=CC=CC=C23)O)Br)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H16BrCl2N3O3/c1-30-21(29)18-17(13-7-6-11(23)9-14(13)24)25-19(22)20(27-18)26-16-12-5-3-2-4-10(12)8-15(16)28/h2-7,9,15-16,28H,8H2,1H3,(H,26,27)