4-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]carbamoyl]benzenesulfonyl fluoride

Systemtic Name: 4-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]carbamoyl]benzenesulfonyl fluoride Openeye Name: 4-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]carbamoyl]benzenesulfonyl fluoride CAS Name: 4-[oxo-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]amino]methyl]benzenesulfonyl fluoride IUPAC Name: 4-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]carbamoyl]benzenesulfonyl fluoride Traditional Name: 4-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]carbamoyl]benzenesulfonyl fluoride Formula: C17H15FN4O3S2 MolecularWeight: 406.454403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)F

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)F

InChI

InChI=1S/C17H15FN4O3S2/c18-27(24,25)14-8-6-13(7-9-14)15(23)20-17-22-21-16(26-17)19-11-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,19,21)(H,20,22,23)