N-butyl-N-[2-[cyclopropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-3-fluoranyl-benzamide

Systemtic Name: N-butyl-N-[2-[cyclopropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-3-fluoranyl-benzamide Openeye Name: N-butyl-N-[2-[cyclopropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-3-fluoro-benzamide CAS Name: N-butyl-N-[2-[cyclopropyl-[(1-methyl-2-pyrrolyl)methyl]amino]-2-oxoethyl]-3-fluorobenzamide IUPAC Name: N-butyl-N-[2-[cyclopropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-3-fluorobenzamide Traditional Name: N-butyl-N-[2-[cyclopropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-3-fluoro-benzamide Formula: C22H28FN3O2 MolecularWeight: 385.475023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CN1C)C2CC2)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CN1C)C2CC2)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H28FN3O2/c1-3-4-13-25(22(28)17-7-5-8-18(23)14-17)16-21(27)26(19-10-11-19)15-20-9-6-12-24(20)2/h5-9,12,14,19H,3-4,10-11,13,15-16H2,1-2H3