3-[(4-bromanyl-2-chloranyl-phenyl)carbamothioylamino]-4-methyl-benzoate

Systemtic Name: 3-[(4-bromanyl-2-chloranyl-phenyl)carbamothioylamino]-4-methyl-benzoate Openeye Name: 3-[(4-bromo-2-chloro-phenyl)carbamothioylamino]-4-methyl-benzoate CAS Name: 3-[[(4-bromo-2-chloroanilino)-sulfanylidenemethyl]amino]-4-methylbenzoate IUPAC Name: 3-[(4-bromo-2-chlorophenyl)carbamothioylamino]-4-methylbenzoate Traditional Name: 3-[(4-bromo-2-chloro-phenyl)thiocarbamoylamino]-4-methyl-benzoate Formula: C15H11BrClN2O2S- MolecularWeight: 398.68204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC(=S)NC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NC(=S)NC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C15H12BrClN2O2S/c1-8-2-3-9(14(20)21)6-13(8)19-15(22)18-12-5-4-10(16)7-11(12)17/h2-7H,1H3,(H,20,21)(H2,18,19,22)/p-1