5-bromanyl-7-ethyl-3-[[4-(pyridin-4-ylmethyl)phenyl]amino]indol-2-one

Systemtic Name: 5-bromanyl-7-ethyl-3-[[4-(pyridin-4-ylmethyl)phenyl]amino]indol-2-one Openeye Name: 5-bromo-7-ethyl-3-[4-(4-pyridylmethyl)anilino]indol-2-one CAS Name: 5-bromo-7-ethyl-3-[4-(pyridin-4-ylmethyl)anilino]-2-indolone IUPAC Name: 5-bromo-7-ethyl-3-[4-(pyridin-4-ylmethyl)anilino]indol-2-one Traditional Name: 5-bromo-7-ethyl-3-[4-(4-pyridylmethyl)anilino]indol-2-one Formula: C22H18BrN3O MolecularWeight: 420.30182

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC2=C(C(=O)N=C12)NC3=CC=C(C=C3)CC4=CC=NC=C4)Br

Isomeric SMILES

CCC1=CC(=CC2=C(C(=O)N=C12)NC3=CC=C(C=C3)CC4=CC=NC=C4)Br

InChI

InChI=1S/C22H18BrN3O/c1-2-16-12-17(23)13-19-20(16)26-22(27)21(19)25-18-5-3-14(4-6-18)11-15-7-9-24-10-8-15/h3-10,12-13H,2,11H2,1H3,(H,25,26,27)