N-butyl-N-[2-[cyclopropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-fluoranyl-benzamide

Systemtic Name: N-butyl-N-[2-[cyclopropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-fluoranyl-benzamide Openeye Name: N-butyl-N-[2-[cyclopropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-4-fluoro-benzamide CAS Name: N-butyl-N-[2-[cyclopropyl-[(1-methyl-2-pyrrolyl)methyl]amino]-2-oxoethyl]-4-fluorobenzamide IUPAC Name: N-butyl-N-[2-[cyclopropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-4-fluorobenzamide Traditional Name: N-butyl-N-[2-[cyclopropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-4-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=C(C=C3)F

Isomeric SMILES

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

InChI

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