methyl 3-[(2,5-dimethoxyphenyl)carbamothioylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[(2,5-dimethoxyphenyl)carbamothioylamino]-4-methyl-benzoate Openeye Name: methyl 3-[(2,5-dimethoxyphenyl)carbamothioylamino]-4-methyl-benzoate CAS Name: 3-[[(2,5-dimethoxyanilino)-sulfanylidenemethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(2,5-dimethoxyphenyl)carbamothioylamino]-4-methylbenzoate Traditional Name: 3-[(2,5-dimethoxyphenyl)thiocarbamoylamino]-4-methyl-benzoic acid methyl ester Formula: C18H20N2O4S MolecularWeight: 360.4274

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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)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O4S/c1-11-5-6-12(17(21)24-4)9-14(11)19-18(25)20-15-10-13(22-2)7-8-16(15)23-3/h5-10H,1-4H3,(H2,19,20,25)