2-methylpropyl 4-(phenylcarbamothioylamino)benzoate

Systemtic Name: 2-methylpropyl 4-(phenylcarbamothioylamino)benzoate Openeye Name: isobutyl 4-(phenylcarbamothioylamino)benzoate CAS Name: 4-[[anilino(sulfanylidene)methyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-(phenylcarbamothioylamino)benzoate Traditional Name: 4-(phenylthiocarbamoylamino)benzoic acid isobutyl ester Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O2S/c1-13(2)12-22-17(21)14-8-10-16(11-9-14)20-18(23)19-15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3,(H2,19,20,23)