methyl 5-[[(3-fluoranyl-4-methyl-phenyl)carbamothioylamino]methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[[(3-fluoranyl-4-methyl-phenyl)carbamothioylamino]methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[[(3-fluoro-4-methyl-phenyl)carbamothioylamino]methyl]-2-methoxy-benzoate CAS Name: 5-[[[(3-fluoro-4-methylanilino)-sulfanylidenemethyl]amino]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[[(3-fluoro-4-methylphenyl)carbamothioylamino]methyl]-2-methoxybenzoate Traditional Name: 5-[[(3-fluoro-4-methyl-phenyl)thiocarbamoylamino]methyl]-2-methoxy-benzoic acid methyl ester Formula: C18H19FN2O3S MolecularWeight: 362.418463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19FN2O3S/c1-11-4-6-13(9-15(11)19)21-18(25)20-10-12-5-7-16(23-2)14(8-12)17(22)24-3/h4-9H,10H2,1-3H3,(H2,20,21,25)