N-[(2S)-1-[2-(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylhydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[(2S)-1-[2-(4-bromanyl-1-methyl-pyrrol-2-yl)carbonylhydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[(1S)-1-[[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]carbamoyl]-2-methyl-propyl]-4-fluoro-benzamide CAS Name: N-[(2S)-1-[[(4-bromo-1-methyl-2-pyrrolyl)-oxomethyl]hydrazo]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide IUPAC Name: N-[(2S)-1-[2-(4-bromo-1-methylpyrrole-2-carbonyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide Traditional Name: N-[(1S)-1-[[(4-bromo-1-methyl-pyrrole-2-carbonyl)amino]carbamoyl]-2-methyl-propyl]-4-fluoro-benzamide Formula: C18H20BrFN4O3 MolecularWeight: 439.278803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NNC(=O)C1=CC(=CN1C)Br)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)[C@@H](C(=O)NNC(=O)C1=CC(=CN1C)Br)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H20BrFN4O3/c1-10(2)15(21-16(25)11-4-6-13(20)7-5-11)18(27)23-22-17(26)14-8-12(19)9-24(14)3/h4-10,15H,1-3H3,(H,21,25)(H,22,26)(H,23,27)/t15-/m0/s1