7-bromanyl-N-(3-chloranyl-4-fluoranyl-phenyl)-5-cyclopropyl-8-(3-pyrrolidin-1-ylpropoxy)pyridazino[4,5-b]indol-1-amine

Systemtic Name: 7-bromanyl-N-(3-chloranyl-4-fluoranyl-phenyl)-5-cyclopropyl-8-(3-pyrrolidin-1-ylpropoxy)pyridazino[4,5-b]indol-1-amine Openeye Name: 7-bromo-N-(3-chloro-4-fluoro-phenyl)-5-cyclopropyl-8-(3-pyrrolidin-1-ylpropoxy)pyridazino[4,5-b]indol-1-amine CAS Name: 7-bromo-N-(3-chloro-4-fluorophenyl)-5-cyclopropyl-8-[3-(1-pyrrolidinyl)propoxy]-1-pyridazino[4,5-b]indolamine IUPAC Name: 7-bromo-N-(3-chloro-4-fluorophenyl)-5-cyclopropyl-8-(3-pyrrolidin-1-ylpropoxy)pyridazino[4,5-b]indol-1-amine Traditional Name: [7-bromo-5-cyclopropyl-8-(3-pyrrolidinopropoxy)pyridazin[4,5-b]indol-1-yl]-(3-chloro-4-fluoro-phenyl)amine Formula: C26H26BrClFN5O MolecularWeight: 558.872943

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCOC2=C(C=C3C(=C2)C4=C(N=NC=C4N3C5CC5)NC6=CC(=C(C=C6)F)Cl)Br

Isomeric SMILES

C1CCN(C1)CCCOC2=C(C=C3C(=C2)C4=C(N=NC=C4N3C5CC5)NC6=CC(=C(C=C6)F)Cl)Br

InChI

InChI=1S/C26H26BrClFN5O/c27-19-14-22-18(13-24(19)35-11-3-10-33-8-1-2-9-33)25-23(34(22)17-5-6-17)15-30-32-26(25)31-16-4-7-21(29)20(28)12-16/h4,7,12-15,17H,1-3,5-6,8-11H2,(H,31,32)