7-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6-(thiophen-2-ylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one

Systemtic Name: 7-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6-(thiophen-2-ylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one Openeye Name: 7-(4-bromo-2-fluoro-anilino)-6-(2-thienylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one CAS Name: 7-(4-bromo-2-fluoroanilino)-6-(thiophen-2-ylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one IUPAC Name: 7-(4-bromo-2-fluoroanilino)-6-(thiophen-2-ylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one Traditional Name: 7-(4-bromo-2-fluoro-anilino)-6-(2-thenyl)-7H-pyrrolo[3,4-b]pyridin-5-one Formula: C18H13BrFN3OS MolecularWeight: 418.282723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(N(C2=O)CC3=CC=CS3)NC4=C(C=C(C=C4)Br)F)N=C1

Isomeric SMILES

C1=CC2=C(C(N(C2=O)CC3=CC=CS3)NC4=C(C=C(C=C4)Br)F)N=C1

InChI

InChI=1S/C18H13BrFN3OS/c19-11-5-6-15(14(20)9-11)22-17-16-13(4-1-7-21-16)18(24)23(17)10-12-3-2-8-25-12/h1-9,17,22H,10H2