2-[8-fluoranyl-4-oxidanylidene-3-[(2S)-2-phenylpropyl]pyrimido[5,4-b]indol-5-yl]ethanamide

Systemtic Name: 2-[8-fluoranyl-4-oxidanylidene-3-[(2S)-2-phenylpropyl]pyrimido[5,4-b]indol-5-yl]ethanamide Openeye Name: 2-[8-fluoro-4-oxo-3-[(2S)-2-phenylpropyl]pyrimido[5,4-b]indol-5-yl]acetamide CAS Name: 2-[8-fluoro-4-oxo-3-[(2S)-2-phenylpropyl]-5-pyrimido[5,4-b]indolyl]acetamide IUPAC Name: 2-[8-fluoro-4-oxo-3-[(2S)-2-phenylpropyl]pyrimido[5,4-b]indol-5-yl]acetamide Traditional Name: 2-[8-fluoro-4-keto-3-[(2S)-2-phenylpropyl]pyrimid[5,4-b]indol-5-yl]acetamide Formula: C21H19FN4O2 MolecularWeight: 378.399563

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=NC2=C(C1=O)N(C3=C2C=C(C=C3)F)CC(=O)N)C4=CC=CC=C4

Isomeric SMILES

C[C@H](CN1C=NC2=C(C1=O)N(C3=C2C=C(C=C3)F)CC(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C21H19FN4O2/c1-13(14-5-3-2-4-6-14)10-25-12-24-19-16-9-15(22)7-8-17(16)26(11-18(23)27)20(19)21(25)28/h2-9,12-13H,10-11H2,1H3,(H2,23,27)/t13-/m1/s1