7-[(4-bromanyl-3-methyl-phenyl)amino]-6-(3-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one

Systemtic Name: 7-[(4-bromanyl-3-methyl-phenyl)amino]-6-(3-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one Openeye Name: 7-(4-bromo-3-methyl-anilino)-6-(3-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one CAS Name: 7-(4-bromo-3-methylanilino)-6-(3-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one IUPAC Name: 7-(4-bromo-3-methylanilino)-6-(3-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one Traditional Name: 7-(4-bromo-3-methyl-anilino)-6-(3-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one Formula: C21H18BrN3O2 MolecularWeight: 424.29052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2C3=C(C=CC=N3)C(=O)N2C4=CC(=CC=C4)OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC2C3=C(C=CC=N3)C(=O)N2C4=CC(=CC=C4)OC)Br

InChI

InChI=1S/C21H18BrN3O2/c1-13-11-14(8-9-18(13)22)24-20-19-17(7-4-10-23-19)21(26)25(20)15-5-3-6-16(12-15)27-2/h3-12,20,24H,1-2H3