3-fluoranyl-4-(3-imidazol-1-ylpropylamino)benzenecarbothioamide

Systemtic Name: 3-fluoranyl-4-(3-imidazol-1-ylpropylamino)benzenecarbothioamide Openeye Name: 3-fluoro-4-(3-imidazol-1-ylpropylamino)benzenecarbothioamide CAS Name: 3-fluoro-4-[3-(1-imidazolyl)propylamino]benzenecarbothioamide IUPAC Name: 3-fluoro-4-(3-imidazol-1-ylpropylamino)benzenecarbothioamide Traditional Name: 3-fluoro-4-(3-imidazol-1-ylpropylamino)thiobenzamide Formula: C13H15FN4S MolecularWeight: 278.348403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=S)N)F)NCCCN2C=CN=C2

Isomeric SMILES

C1=CC(=C(C=C1C(=S)N)F)NCCCN2C=CN=C2

InChI

InChI=1S/C13H15FN4S/c14-11-8-10(13(15)19)2-3-12(11)17-4-1-6-18-7-5-16-9-18/h2-3,5,7-9,17H,1,4,6H2,(H2,15,19)