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

Systemtic Name: N-butyl-4-fluoranyl-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-N-butyl-4-fluoro-benzamide CAS Name: N-butyl-4-fluoro-N-[2-[(1-methyl-2-pyrrolyl)methyl-(phenylmethyl)amino]-2-oxoethyl]benzamide IUPAC Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-butyl-4-fluorobenzamide Traditional Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-N-butyl-4-fluoro-benzamide Formula: C26H30FN3O2 MolecularWeight: 435.533703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C26H30FN3O2/c1-3-4-17-29(26(32)22-12-14-23(27)15-13-22)20-25(31)30(18-21-9-6-5-7-10-21)19-24-11-8-16-28(24)2/h5-16H,3-4,17-20H2,1-2H3