5-azanyl-6-fluoranyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-2-oxidanylidene-3-propan-2-yl-benzimidazole-1-carboxamide

Systemtic Name: 5-azanyl-6-fluoranyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-2-oxidanylidene-3-propan-2-yl-benzimidazole-1-carboxamide Openeye Name: 5-amino-6-fluoro-3-isopropyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-2-oxo-benzimidazole-1-carboxamide CAS Name: 5-amino-6-fluoro-N-[2-(4-methyl-1-piperazinyl)ethyl]-2-oxo-3-propan-2-yl-1-benzimidazolecarboxamide IUPAC Name: 5-amino-6-fluoro-N-[2-(4-methylpiperazin-1-yl)ethyl]-2-oxo-3-propan-2-ylbenzimidazole-1-carboxamide Traditional Name: 5-amino-6-fluoro-3-isopropyl-2-keto-N-[2-(4-methylpiperazino)ethyl]benzimidazole-1-carboxamide Formula: C18H27FN6O2 MolecularWeight: 378.444383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=CC(=C(C=C2N(C1=O)C(=O)NCCN3CCN(CC3)C)F)N

Isomeric SMILES

CC(C)N1C2=CC(=C(C=C2N(C1=O)C(=O)NCCN3CCN(CC3)C)F)N

InChI

InChI=1S/C18H27FN6O2/c1-12(2)24-16-11-14(20)13(19)10-15(16)25(18(24)27)17(26)21-4-5-23-8-6-22(3)7-9-23/h10-12H,4-9,20H2,1-3H3,(H,21,26)