N-[4-[2-(2-fluorophenyl)ethylcarbamothioylamino]phenyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[4-[2-(2-fluorophenyl)ethylcarbamothioylamino]phenyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[4-[2-(2-fluorophenyl)ethylcarbamothioylamino]phenyl]thiadiazole-4-carboxamide CAS Name: N-[4-[[[2-(2-fluorophenyl)ethylamino]-sulfanylidenemethyl]amino]phenyl]-4-thiadiazolecarboxamide IUPAC Name: N-[4-[2-(2-fluorophenyl)ethylcarbamothioylamino]phenyl]thiadiazole-4-carboxamide Traditional Name: N-[4-[2-(2-fluorophenyl)ethylthiocarbamoylamino]phenyl]thiadiazole-4-carboxamide Formula: C18H16FN5OS2 MolecularWeight: 401.480943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCNC(=S)NC2=CC=C(C=C2)NC(=O)C3=CSN=N3)F

Isomeric SMILES

C1=CC=C(C(=C1)CCNC(=S)NC2=CC=C(C=C2)NC(=O)C3=CSN=N3)F

InChI

InChI=1S/C18H16FN5OS2/c19-15-4-2-1-3-12(15)9-10-20-18(26)22-14-7-5-13(6-8-14)21-17(25)16-11-27-24-23-16/h1-8,11H,9-10H2,(H,21,25)(H2,20,22,26)