N-(2-azanyl-5-thiophen-2-yl-phenyl)-4-[[(3-fluoranyl-4-methoxy-phenyl)amino]methyl]benzamide

Systemtic Name: N-(2-azanyl-5-thiophen-2-yl-phenyl)-4-[[(3-fluoranyl-4-methoxy-phenyl)amino]methyl]benzamide Openeye Name: N-[2-amino-5-(2-thienyl)phenyl]-4-[(3-fluoro-4-methoxy-anilino)methyl]benzamide CAS Name: N-(2-amino-5-thiophen-2-ylphenyl)-4-[(3-fluoro-4-methoxyanilino)methyl]benzamide IUPAC Name: N-(2-amino-5-thiophen-2-ylphenyl)-4-[(3-fluoro-4-methoxyanilino)methyl]benzamide Traditional Name: N-[2-amino-5-(2-thienyl)phenyl]-4-[(3-fluoro-4-methoxy-anilino)methyl]benzamide Formula: C25H22FN3O2S MolecularWeight: 447.524483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NCC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC=CS4)N)F

Isomeric SMILES

COC1=C(C=C(C=C1)NCC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC=CS4)N)F

InChI

InChI=1S/C25H22FN3O2S/c1-31-23-11-9-19(14-20(23)26)28-15-16-4-6-17(7-5-16)25(30)29-22-13-18(8-10-21(22)27)24-3-2-12-32-24/h2-14,28H,15,27H2,1H3,(H,29,30)