4-azanyl-5-[(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoyl]-1,2-thiazole-3-carboxamide

Systemtic Name: 4-azanyl-5-[(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoyl]-1,2-thiazole-3-carboxamide Openeye Name: 4-amino-5-[(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoyl]isothiazole-3-carboxamide CAS Name: 4-amino-5-[(E)-1-oxo-3-[4-(trifluoromethyl)phenyl]prop-2-enyl]-3-isothiazolecarboxamide IUPAC Name: 4-amino-5-[(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoyl]-1,2-thiazole-3-carboxamide Traditional Name: 4-amino-5-[(E)-3-[4-(trifluoromethyl)phenyl]acryloyl]isothiazole-3-carboxamide Formula: C14H10F3N3O2S MolecularWeight: 341.30831

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)C2=C(C(=NS2)C(=O)N)N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)C2=C(C(=NS2)C(=O)N)N)C(F)(F)F

InChI

InChI=1S/C14H10F3N3O2S/c15-14(16,17)8-4-1-7(2-5-8)3-6-9(21)12-10(18)11(13(19)22)20-23-12/h1-6H,18H2,(H2,19,22)/b6-3+