N-[3-[2-(5-carbamimidoyl-2-methylsulfanyl-thiophen-3-yl)-1,3-thiazol-4-yl]phenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[3-[2-(5-carbamimidoyl-2-methylsulfanyl-thiophen-3-yl)-1,3-thiazol-4-yl]phenyl]-4-fluoranyl-benzamide Openeye Name: N-[3-[2-(5-carbamimidoyl-2-methylsulfanyl-3-thienyl)thiazol-4-yl]phenyl]-4-fluoro-benzamide CAS Name: N-[3-[2-[5-carbamimidoyl-2-(methylthio)-3-thiophenyl]-4-thiazolyl]phenyl]-4-fluorobenzamide IUPAC Name: N-[3-[2-(5-carbamimidoyl-2-methylsulfanylthiophen-3-yl)-1,3-thiazol-4-yl]phenyl]-4-fluorobenzamide Traditional Name: N-[3-[2-[5-amidino-2-(methylthio)-3-thienyl]thiazol-4-yl]phenyl]-4-fluoro-benzamide Formula: C22H17FN4OS3 MolecularWeight: 468.589983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(S1)C(=N)N)C2=NC(=CS2)C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CSC1=C(C=C(S1)C(=N)N)C2=NC(=CS2)C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H17FN4OS3/c1-29-22-16(10-18(31-22)19(24)25)21-27-17(11-30-21)13-3-2-4-15(9-13)26-20(28)12-5-7-14(23)8-6-12/h2-11H,1H3,(H3,24,25)(H,26,28)