N-[(3,5-dimethoxyphenyl)methyl]-8-fluoranyl-5H-pyrimido[5,4-b]indol-4-amine

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]-8-fluoranyl-5H-pyrimido[5,4-b]indol-4-amine Openeye Name: N-[(3,5-dimethoxyphenyl)methyl]-8-fluoro-5H-pyrimido[5,4-b]indol-4-amine CAS Name: N-[(3,5-dimethoxyphenyl)methyl]-8-fluoro-5H-pyrimido[5,4-b]indol-4-amine IUPAC Name: N-[(3,5-dimethoxyphenyl)methyl]-8-fluoro-5H-pyrimido[5,4-b]indol-4-amine Traditional Name: (3,5-dimethoxybenzyl)-(8-fluoro-5H-pyrimid[5,4-b]indol-4-yl)amine Formula: C19H17FN4O2 MolecularWeight: 352.362283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNC2=NC=NC3=C2NC4=C3C=C(C=C4)F)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNC2=NC=NC3=C2NC4=C3C=C(C=C4)F)OC

InChI

InChI=1S/C19H17FN4O2/c1-25-13-5-11(6-14(8-13)26-2)9-21-19-18-17(22-10-23-19)15-7-12(20)3-4-16(15)24-18/h3-8,10,24H,9H2,1-2H3,(H,21,22,23)