propan-2-yl 2-chloranyl-5-(dimethylcarbamothioylamino)benzoate

Systemtic Name: propan-2-yl 2-chloranyl-5-(dimethylcarbamothioylamino)benzoate Openeye Name: isopropyl 2-chloro-5-(dimethylcarbamothioylamino)benzoate CAS Name: 2-chloro-5-[[dimethylamino(sulfanylidene)methyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-chloro-5-(dimethylcarbamothioylamino)benzoate Traditional Name: 2-chloro-5-(dimethylthiocarbamoylamino)benzoic acid isopropyl ester Formula: C13H17ClN2O2S MolecularWeight: 300.80428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C=CC(=C1)NC(=S)N(C)C)Cl

Isomeric SMILES

CC(C)OC(=O)C1=C(C=CC(=C1)NC(=S)N(C)C)Cl

InChI

InChI=1S/C13H17ClN2O2S/c1-8(2)18-12(17)10-7-9(5-6-11(10)14)15-13(19)16(3)4/h5-8H,1-4H3,(H,15,19)