methyl 2-methoxy-5-[[(4-methylphenyl)carbamothioylamino]methyl]benzoate

Systemtic Name: methyl 2-methoxy-5-[[(4-methylphenyl)carbamothioylamino]methyl]benzoate Openeye Name: methyl 2-methoxy-5-[(p-tolylcarbamothioylamino)methyl]benzoate CAS Name: 2-methoxy-5-[[[(4-methylanilino)-sulfanylidenemethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-5-[[(4-methylphenyl)carbamothioylamino]methyl]benzoate Traditional Name: 2-methoxy-5-[(p-tolylthiocarbamoylamino)methyl]benzoic acid methyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3S/c1-12-4-7-14(8-5-12)20-18(24)19-11-13-6-9-16(22-2)15(10-13)17(21)23-3/h4-10H,11H2,1-3H3,(H2,19,20,24)