1-(3,3-dimethylbutan-2-ylamino)-8-fluoranyl-5H-pyrido[4,3-b]indole-4-carboxamide

Systemtic Name: 1-(3,3-dimethylbutan-2-ylamino)-8-fluoranyl-5H-pyrido[4,3-b]indole-4-carboxamide Openeye Name: 8-fluoro-1-(1,2,2-trimethylpropylamino)-5H-pyrido[4,3-b]indole-4-carboxamide CAS Name: 1-(3,3-dimethylbutan-2-ylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide IUPAC Name: 1-(3,3-dimethylbutan-2-ylamino)-8-fluoro-5H-pyrido[4,3-b]indole-4-carboxamide Traditional Name: 8-fluoro-1-(1,2,2-trimethylpropylamino)-5H-pyrid[4,3-b]indole-4-carboxamide Formula: C18H21FN4O MolecularWeight: 328.383943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)NC1=NC=C(C2=C1C3=C(N2)C=CC(=C3)F)C(=O)N

Isomeric SMILES

CC(C(C)(C)C)NC1=NC=C(C2=C1C3=C(N2)C=CC(=C3)F)C(=O)N

InChI

InChI=1S/C18H21FN4O/c1-9(18(2,3)4)22-17-14-11-7-10(19)5-6-13(11)23-15(14)12(8-21-17)16(20)24/h5-9,23H,1-4H3,(H2,20,24)(H,21,22)