methyl 5-[[(3,5-dimethylphenyl)carbamothioylamino]methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[[(3,5-dimethylphenyl)carbamothioylamino]methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[[(3,5-dimethylphenyl)carbamothioylamino]methyl]-2-methoxy-benzoate CAS Name: 5-[[[(3,5-dimethylanilino)-sulfanylidenemethyl]amino]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[[(3,5-dimethylphenyl)carbamothioylamino]methyl]-2-methoxybenzoate Traditional Name: 5-[[(3,5-dimethylphenyl)thiocarbamoylamino]methyl]-2-methoxy-benzoic acid methyl ester Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NCC2=CC(=C(C=C2)OC)C(=O)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NCC2=CC(=C(C=C2)OC)C(=O)OC)C

InChI

InChI=1S/C19H22N2O3S/c1-12-7-13(2)9-15(8-12)21-19(25)20-11-14-5-6-17(23-3)16(10-14)18(22)24-4/h5-10H,11H2,1-4H3,(H2,20,21,25)