(Z)-3-azanyl-2-cyano-4-methyl-N-[4-(trifluoromethyl)phenyl]pent-2-enethioamide

Systemtic Name: (Z)-3-azanyl-2-cyano-4-methyl-N-[4-(trifluoromethyl)phenyl]pent-2-enethioamide Openeye Name: (Z)-3-amino-2-cyano-4-methyl-N-[4-(trifluoromethyl)phenyl]pent-2-enethioamide CAS Name: (Z)-3-amino-2-cyano-4-methyl-N-[4-(trifluoromethyl)phenyl]-2-pentenethioamide IUPAC Name: (Z)-3-amino-2-cyano-4-methyl-N-[4-(trifluoromethyl)phenyl]pent-2-enethioamide Traditional Name: (Z)-3-amino-2-cyano-4-methyl-N-[4-(trifluoromethyl)phenyl]pent-2-enethioamide Formula: C14H14F3N3S MolecularWeight: 313.34127

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=C(C#N)C(=S)NC1=CC=C(C=C1)C(F)(F)F)N

Isomeric SMILES

CC(C)/C(=C(\C#N)/C(=S)NC1=CC=C(C=C1)C(F)(F)F)/N

InChI

InChI=1S/C14H14F3N3S/c1-8(2)12(19)11(7-18)13(21)20-10-5-3-9(4-6-10)14(15,16)17/h3-6,8H,19H2,1-2H3,(H,20,21)/b12-11-