N-butyl-4-fluoranyl-N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: N-butyl-4-fluoranyl-N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-N-butyl-4-fluoro-benzamide CAS Name: N-butyl-4-fluoro-N-[2-[(5-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]benzamide IUPAC Name: N-[2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-N-butyl-4-fluorobenzamide Traditional Name: N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-N-butyl-4-fluoro-benzamide Formula: C26H29FN2O2S MolecularWeight: 452.584063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=C(S2)C)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=C(S2)C)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C26H29FN2O2S/c1-3-4-16-28(26(31)22-11-13-23(27)14-12-22)19-25(30)29(17-21-8-6-5-7-9-21)18-24-15-10-20(2)32-24/h5-15H,3-4,16-19H2,1-2H3