(Z)-2-cyano-3-[(3-fluorophenyl)methylamino]but-2-enethioamide

Systemtic Name: (Z)-2-cyano-3-[(3-fluorophenyl)methylamino]but-2-enethioamide Openeye Name: (Z)-2-cyano-3-[(3-fluorophenyl)methylamino]but-2-enethioamide CAS Name: (Z)-2-cyano-3-[(3-fluorophenyl)methylamino]-2-butenethioamide IUPAC Name: (Z)-2-cyano-3-[(3-fluorophenyl)methylamino]but-2-enethioamide Traditional Name: (Z)-2-cyano-3-[(3-fluorobenzyl)amino]but-2-enethioamide Formula: C12H12FN3S MolecularWeight: 249.307183

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=S)N)NCC1=CC(=CC=C1)F

Isomeric SMILES

C/C(=C(\C#N)/C(=S)N)/NCC1=CC(=CC=C1)F

InChI

InChI=1S/C12H12FN3S/c1-8(11(6-14)12(15)17)16-7-9-3-2-4-10(13)5-9/h2-5,16H,7H2,1H3,(H2,15,17)/b11-8-