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

Systemtic Name: N-[2,2-bis(chloranyl)-1-[(3-methylphenyl)carbamothioylamino]ethyl]-4-methyl-benzamide Openeye Name: N-[2,2-dichloro-1-(m-tolylcarbamothioylamino)ethyl]-4-methyl-benzamide CAS Name: N-[2,2-dichloro-1-[[(3-methylanilino)-sulfanylidenemethyl]amino]ethyl]-4-methylbenzamide IUPAC Name: N-[2,2-dichloro-1-[(3-methylphenyl)carbamothioylamino]ethyl]-4-methylbenzamide Traditional Name: N-[2,2-dichloro-1-(m-tolylthiocarbamoylamino)ethyl]-4-methyl-benzamide Formula: C18H19Cl2N3OS MolecularWeight: 396.33396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19Cl2N3OS/c1-11-6-8-13(9-7-11)17(24)22-16(15(19)20)23-18(25)21-14-5-3-4-12(2)10-14/h3-10,15-16H,1-2H3,(H,22,24)(H2,21,23,25)