4-azanyl-N-(phenylmethyl)-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide

Systemtic Name: 4-azanyl-N-(phenylmethyl)-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide Openeye Name: 4-amino-N-benzyl-2-thioxo-3-[3-(trifluoromethyl)phenyl]thiazole-5-carboxamide CAS Name: 4-amino-N-(phenylmethyl)-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-5-thiazolecarboxamide IUPAC Name: 4-amino-N-benzyl-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide Traditional Name: 4-amino-N-benzyl-2-thioxo-3-[3-(trifluoromethyl)phenyl]-4-thiazoline-5-carboxamide Formula: C18H14F3N3OS2 MolecularWeight: 409.44847

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=C(N(C(=S)S2)C3=CC=CC(=C3)C(F)(F)F)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=C(N(C(=S)S2)C3=CC=CC(=C3)C(F)(F)F)N

InChI

InChI=1S/C18H14F3N3OS2/c19-18(20,21)12-7-4-8-13(9-12)24-15(22)14(27-17(24)26)16(25)23-10-11-5-2-1-3-6-11/h1-9H,10,22H2,(H,23,25)