methyl 2-methoxy-5-[[(2-propan-2-ylphenyl)carbamothioylamino]methyl]benzoate

Systemtic Name: methyl 2-methoxy-5-[[(2-propan-2-ylphenyl)carbamothioylamino]methyl]benzoate Openeye Name: methyl 5-[[(2-isopropylphenyl)carbamothioylamino]methyl]-2-methoxy-benzoate CAS Name: 2-methoxy-5-[[[(2-propan-2-ylanilino)-sulfanylidenemethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-5-[[(2-propan-2-ylphenyl)carbamothioylamino]methyl]benzoate Traditional Name: 2-methoxy-5-[(o-cumenylthiocarbamoylamino)methyl]benzoic acid methyl ester Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=S)NCC2=CC(=C(C=C2)OC)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=S)NCC2=CC(=C(C=C2)OC)C(=O)OC

InChI

InChI=1S/C20H24N2O3S/c1-13(2)15-7-5-6-8-17(15)22-20(26)21-12-14-9-10-18(24-3)16(11-14)19(23)25-4/h5-11,13H,12H2,1-4H3,(H2,21,22,26)