3-[(2-azanyl-4-methyl-1,3-thiazol-5-yl)sulfanylmethyl]-4-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[(2-azanyl-4-methyl-1,3-thiazol-5-yl)sulfanylmethyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(2-amino-4-methyl-thiazol-5-yl)sulfanylmethyl]-4-fluoro-benzonitrile CAS Name: 3-[[(2-amino-4-methyl-5-thiazolyl)thio]methyl]-4-fluorobenzonitrile IUPAC Name: 3-[(2-amino-4-methyl-1,3-thiazol-5-yl)sulfanylmethyl]-4-fluorobenzonitrile Traditional Name: 3-[[(2-amino-4-methyl-thiazol-5-yl)thio]methyl]-4-fluoro-benzonitrile Formula: C12H10FN3S2 MolecularWeight: 279.356303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N)SCC2=C(C=CC(=C2)C#N)F

Isomeric SMILES

CC1=C(SC(=N1)N)SCC2=C(C=CC(=C2)C#N)F

InChI

InChI=1S/C12H10FN3S2/c1-7-11(18-12(15)16-7)17-6-9-4-8(5-14)2-3-10(9)13/h2-4H,6H2,1H3,(H2,15,16)