4-(benzotriazol-1-ylmethyl)-N-[4-(3-fluoranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-[4-(3-fluoranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-[4-(3-fluoro-4-methoxy-phenyl)thiazol-2-yl]benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[4-(3-fluoro-4-methoxyphenyl)-2-thiazolyl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-[4-(3-fluoro-4-methoxy-phenyl)thiazol-2-yl]benzamide Formula: C24H18FN5O2S MolecularWeight: 459.495423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4)F

InChI

InChI=1S/C24H18FN5O2S/c1-32-22-11-10-17(12-18(22)25)20-14-33-24(26-20)27-23(31)16-8-6-15(7-9-16)13-30-21-5-3-2-4-19(21)28-29-30/h2-12,14H,13H2,1H3,(H,26,27,31)