4-methyl-N-[2,2,2-tris(chloranyl)-1-(pyrimidin-5-ylcarbothioylamino)ethyl]benzamide

Systemtic Name: 4-methyl-N-[2,2,2-tris(chloranyl)-1-(pyrimidin-5-ylcarbothioylamino)ethyl]benzamide Openeye Name: 4-methyl-N-[2,2,2-trichloro-1-(pyrimidine-5-carbothioylamino)ethyl]benzamide CAS Name: 4-methyl-N-[2,2,2-trichloro-1-[[5-pyrimidinyl(sulfanylidene)methyl]amino]ethyl]benzamide IUPAC Name: 4-methyl-N-[2,2,2-trichloro-1-(pyrimidine-5-carbothioylamino)ethyl]benzamide Traditional Name: 4-methyl-N-[2,2,2-trichloro-1-(pyrimidine-5-carbothioylamino)ethyl]benzamide Formula: C15H13Cl3N4OS MolecularWeight: 403.71392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)C2=CN=CN=C2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)C2=CN=CN=C2

InChI

InChI=1S/C15H13Cl3N4OS/c1-9-2-4-10(5-3-9)12(23)21-14(15(16,17)18)22-13(24)11-6-19-8-20-7-11/h2-8,14H,1H3,(H,21,23)(H,22,24)