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

Systemtic Name: methyl 2-[(3-chloranyl-2-methyl-phenyl)carbamothioylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[(3-chloro-2-methyl-phenyl)carbamothioylamino]-4,5-dimethoxy-benzoate CAS Name: 2-[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[(3-chloro-2-methylphenyl)carbamothioylamino]-4,5-dimethoxybenzoate Traditional Name: 2-[(3-chloro-2-methyl-phenyl)thiocarbamoylamino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C18H19ClN2O4S MolecularWeight: 394.87246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NC2=CC(=C(C=C2C(=O)OC)OC)OC

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NC2=CC(=C(C=C2C(=O)OC)OC)OC

InChI

InChI=1S/C18H19ClN2O4S/c1-10-12(19)6-5-7-13(10)20-18(26)21-14-9-16(24-3)15(23-2)8-11(14)17(22)25-4/h5-9H,1-4H3,(H2,20,21,26)