N-butyl-2-fluoranyl-N-[2-oxidanylidene-2-[[1-(phenylmethyl)pyrrol-2-yl]methyl-propan-2-yl-amino]ethyl]benzamide

Systemtic Name: N-butyl-2-fluoranyl-N-[2-oxidanylidene-2-[[1-(phenylmethyl)pyrrol-2-yl]methyl-propan-2-yl-amino]ethyl]benzamide Openeye Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-isopropyl-amino]-2-oxo-ethyl]-N-butyl-2-fluoro-benzamide CAS Name: N-butyl-2-fluoro-N-[2-oxo-2-[[1-(phenylmethyl)-2-pyrrolyl]methyl-propan-2-ylamino]ethyl]benzamide IUPAC Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-propan-2-ylamino]-2-oxoethyl]-N-butyl-2-fluorobenzamide Traditional Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-isopropyl-amino]-2-keto-ethyl]-N-butyl-2-fluoro-benzamide Formula: C28H34FN3O2 MolecularWeight: 463.586863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C(C)C)C(=O)C3=CC=CC=C3F

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C(C)C)C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C28H34FN3O2/c1-4-5-17-31(28(34)25-15-9-10-16-26(25)29)21-27(33)32(22(2)3)20-24-14-11-18-30(24)19-23-12-7-6-8-13-23/h6-16,18,22H,4-5,17,19-21H2,1-3H3