N-[[3-(2-methylpyrimidin-4-yl)phenyl]carbamothioyl]-2-phenoxy-ethanamide

Systemtic Name: N-[[3-(2-methylpyrimidin-4-yl)phenyl]carbamothioyl]-2-phenoxy-ethanamide Openeye Name: N-[[3-(2-methylpyrimidin-4-yl)phenyl]carbamothioyl]-2-phenoxy-acetamide CAS Name: N-[[3-(2-methyl-4-pyrimidinyl)anilino]-sulfanylidenemethyl]-2-phenoxyacetamide IUPAC Name: N-[[3-(2-methylpyrimidin-4-yl)phenyl]carbamothioyl]-2-phenoxyacetamide Traditional Name: N-[[3-(2-methylpyrimidin-4-yl)phenyl]thiocarbamoyl]-2-phenoxy-acetamide Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=S)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=S)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C20H18N4O2S/c1-14-21-11-10-18(22-14)15-6-5-7-16(12-15)23-20(27)24-19(25)13-26-17-8-3-2-4-9-17/h2-12H,13H2,1H3,(H2,23,24,25,27)