3-(8-fluoranyl-4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)-N-(pyridin-3-ylmethyl)propanamide

Systemtic Name: 3-(8-fluoranyl-4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)-N-(pyridin-3-ylmethyl)propanamide Openeye Name: 3-(8-fluoro-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)-N-(3-pyridylmethyl)propanamide CAS Name: 3-(8-fluoro-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)-N-(3-pyridinylmethyl)propanamide IUPAC Name: 3-(8-fluoro-4-oxo-5H-pyrimido[5,4-b]indol-3-yl)-N-(pyridin-3-ylmethyl)propanamide Traditional Name: 3-(8-fluoro-4-keto-5H-pyrimid[5,4-b]indol-3-yl)-N-(3-pyridylmethyl)propionamide Formula: C19H16FN5O2 MolecularWeight: 365.361043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=O)CCN2C=NC3=C(C2=O)NC4=C3C=C(C=C4)F

Isomeric SMILES

C1=CC(=CN=C1)CNC(=O)CCN2C=NC3=C(C2=O)NC4=C3C=C(C=C4)F

InChI

InChI=1S/C19H16FN5O2/c20-13-3-4-15-14(8-13)17-18(24-15)19(27)25(11-23-17)7-5-16(26)22-10-12-2-1-6-21-9-12/h1-4,6,8-9,11,24H,5,7,10H2,(H,22,26)