(Z)-3-azanyl-2-cyano-3-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]prop-2-enethioamide

Systemtic Name: (Z)-3-azanyl-2-cyano-3-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]prop-2-enethioamide Openeye Name: (Z)-3-amino-2-cyano-3-(3-pyridyl)-N-[4-(trifluoromethyl)phenyl]prop-2-enethioamide CAS Name: (Z)-3-amino-2-cyano-3-(3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-2-propenethioamide IUPAC Name: (Z)-3-amino-2-cyano-3-pyridin-3-yl-N-[4-(trifluoromethyl)phenyl]prop-2-enethioamide Traditional Name: (Z)-3-amino-2-cyano-3-(3-pyridyl)-N-[4-(trifluoromethyl)phenyl]thioacrylamide Formula: C16H11F3N4S MolecularWeight: 348.34555

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=C(C#N)C(=S)NC2=CC=C(C=C2)C(F)(F)F)N

Isomeric SMILES

C1=CC(=CN=C1)/C(=C(\C#N)/C(=S)NC2=CC=C(C=C2)C(F)(F)F)/N

InChI

InChI=1S/C16H11F3N4S/c17-16(18,19)11-3-5-12(6-4-11)23-15(24)13(8-20)14(21)10-2-1-7-22-9-10/h1-7,9H,21H2,(H,23,24)/b14-13-