methyl N-[[2-azanyl-3,5,6-tris(chloranyl)phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[2-azanyl-3,5,6-tris(chloranyl)phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[(2-amino-3,5,6-trichloro-phenyl)carbamothioyl]carbamate CAS Name: N-[(2-amino-3,5,6-trichloroanilino)-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[(2-amino-3,5,6-trichlorophenyl)carbamothioyl]carbamate Traditional Name: N-[(2-amino-3,5,6-trichloro-phenyl)thiocarbamoyl]carbamic acid methyl ester Formula: C9H8Cl3N3O2S MolecularWeight: 328.60272

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=S)NC1=C(C(=CC(=C1Cl)Cl)Cl)N

Isomeric SMILES

COC(=O)NC(=S)NC1=C(C(=CC(=C1Cl)Cl)Cl)N

InChI

InChI=1S/C9H8Cl3N3O2S/c1-17-9(16)15-8(18)14-7-5(12)3(10)2-4(11)6(7)13/h2H,13H2,1H3,(H2,14,15,16,18)