1-ethyl-3-[4-ethynyl-6-(4-fluorophenyl)-1,3-benzothiazol-2-yl]urea

Systemtic Name: 1-ethyl-3-[4-ethynyl-6-(4-fluorophenyl)-1,3-benzothiazol-2-yl]urea Openeye Name: 1-ethyl-3-[4-ethynyl-6-(4-fluorophenyl)-1,3-benzothiazol-2-yl]urea CAS Name: 1-ethyl-3-[4-ethynyl-6-(4-fluorophenyl)-1,3-benzothiazol-2-yl]urea IUPAC Name: 1-ethyl-3-[4-ethynyl-6-(4-fluorophenyl)-1,3-benzothiazol-2-yl]urea Traditional Name: 1-ethyl-3-[4-ethynyl-6-(4-fluorophenyl)-1,3-benzothiazol-2-yl]urea Formula: C18H14FN3OS MolecularWeight: 339.386663

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(S1)C=C(C=C2C#C)C3=CC=C(C=C3)F

Isomeric SMILES

CCNC(=O)NC1=NC2=C(S1)C=C(C=C2C#C)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H14FN3OS/c1-3-11-9-13(12-5-7-14(19)8-6-12)10-15-16(11)21-18(24-15)22-17(23)20-4-2/h1,5-10H,4H2,2H3,(H2,20,21,22,23)