N-[4-[(4-bromanyl-2-chloranyl-phenyl)carbamothioylamino]phenyl]-N-methyl-ethanamide

Systemtic Name: N-[4-[(4-bromanyl-2-chloranyl-phenyl)carbamothioylamino]phenyl]-N-methyl-ethanamide Openeye Name: N-[4-[(4-bromo-2-chloro-phenyl)carbamothioylamino]phenyl]-N-methyl-acetamide CAS Name: N-[4-[[(4-bromo-2-chloroanilino)-sulfanylidenemethyl]amino]phenyl]-N-methylacetamide IUPAC Name: N-[4-[(4-bromo-2-chlorophenyl)carbamothioylamino]phenyl]-N-methylacetamide Traditional Name: N-[4-[(4-bromo-2-chloro-phenyl)thiocarbamoylamino]phenyl]-N-methyl-acetamide Formula: C16H15BrClN3OS MolecularWeight: 412.7318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrClN3OS/c1-10(22)21(2)13-6-4-12(5-7-13)19-16(23)20-15-8-3-11(17)9-14(15)18/h3-9H,1-2H3,(H2,19,20,23)