methyl 3-[[2,5-bis(chloranyl)phenyl]carbamothioylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[[2,5-bis(chloranyl)phenyl]carbamothioylamino]-4-methyl-benzoate Openeye Name: methyl 3-[(2,5-dichlorophenyl)carbamothioylamino]-4-methyl-benzoate CAS Name: 3-[[(2,5-dichloroanilino)-sulfanylidenemethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(2,5-dichlorophenyl)carbamothioylamino]-4-methylbenzoate Traditional Name: 3-[(2,5-dichlorophenyl)thiocarbamoylamino]-4-methyl-benzoic acid methyl ester Formula: C16H14Cl2N2O2S MolecularWeight: 369.26556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14Cl2N2O2S/c1-9-3-4-10(15(21)22-2)7-13(9)19-16(23)20-14-8-11(17)5-6-12(14)18/h3-8H,1-2H3,(H2,19,20,23)