4-methyl-N-[2,2,2-tris(chloranyl)-1-[(3-methylphenyl)carbamothioylamino]ethyl]benzamide

Systemtic Name: 4-methyl-N-[2,2,2-tris(chloranyl)-1-[(3-methylphenyl)carbamothioylamino]ethyl]benzamide Openeye Name: 4-methyl-N-[2,2,2-trichloro-1-(m-tolylcarbamothioylamino)ethyl]benzamide CAS Name: 4-methyl-N-[2,2,2-trichloro-1-[[(3-methylanilino)-sulfanylidenemethyl]amino]ethyl]benzamide IUPAC Name: 4-methyl-N-[2,2,2-trichloro-1-[(3-methylphenyl)carbamothioylamino]ethyl]benzamide Traditional Name: 4-methyl-N-[2,2,2-trichloro-1-(m-tolylthiocarbamoylamino)ethyl]benzamide Formula: C18H18Cl3N3OS MolecularWeight: 430.77902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=CC(=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=CC(=C2)C

InChI

InChI=1S/C18H18Cl3N3OS/c1-11-6-8-13(9-7-11)15(25)23-16(18(19,20)21)24-17(26)22-14-5-3-4-12(2)10-14/h3-10,16H,1-2H3,(H,23,25)(H2,22,24,26)