2,3,5,6-tetrakis(fluoranyl)-4-methoxy-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 2,3,5,6-tetrakis(fluoranyl)-4-methoxy-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 2,3,5,6-tetrafluoro-4-methoxy-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide CAS Name: 2,3,5,6-tetrafluoro-4-methoxy-N-[[2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2,3,5,6-tetrafluoro-4-methoxy-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 2,3,5,6-tetrafluoro-4-methoxy-N-[(2-pyrrolidinophenyl)thiocarbamoyl]benzamide Formula: C19H17F4N3O2S MolecularWeight: 427.415793

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1F)F)C(=O)NC(=S)NC2=CC=CC=C2N3CCCC3)F)F

Isomeric SMILES

COC1=C(C(=C(C(=C1F)F)C(=O)NC(=S)NC2=CC=CC=C2N3CCCC3)F)F

InChI

InChI=1S/C19H17F4N3O2S/c1-28-17-15(22)13(20)12(14(21)16(17)23)18(27)25-19(29)24-10-6-2-3-7-11(10)26-8-4-5-9-26/h2-3,6-7H,4-5,8-9H2,1H3,(H2,24,25,27,29)