2-[(4-fluorophenyl)methylcarbamoylamino]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)ethanamide

Systemtic Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)ethanamide Openeye Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)acetamide CAS Name: 2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]acetamide IUPAC Name: 2-[(4-fluorophenyl)methylcarbamoylamino]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)acetamide Traditional Name: 2-[(4-fluorobenzyl)carbamoylamino]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]acetamide Formula: C18H17FN4O2S2 MolecularWeight: 404.481583

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CNC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CNC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H17FN4O2S2/c1-26-18-23-14-7-6-13(8-15(14)27-18)22-16(24)10-21-17(25)20-9-11-2-4-12(19)5-3-11/h2-8H,9-10H2,1H3,(H,22,24)(H2,20,21,25)