methyl 5-chloranyl-4-(2,2-dimethylpropanoylcarbamothioylamino)-2-methoxy-benzoate

Systemtic Name: methyl 5-chloranyl-4-(2,2-dimethylpropanoylcarbamothioylamino)-2-methoxy-benzoate Openeye Name: methyl 5-chloro-4-(2,2-dimethylpropanoylcarbamothioylamino)-2-methoxy-benzoate CAS Name: 5-chloro-4-[[[(2,2-dimethyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-chloro-4-(2,2-dimethylpropanoylcarbamothioylamino)-2-methoxybenzoate Traditional Name: 5-chloro-2-methoxy-4-(pivaloylthiocarbamoylamino)benzoic acid methyl ester Formula: C15H19ClN2O4S MolecularWeight: 358.84036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=S)NC1=C(C=C(C(=C1)OC)C(=O)OC)Cl

Isomeric SMILES

CC(C)(C)C(=O)NC(=S)NC1=C(C=C(C(=C1)OC)C(=O)OC)Cl

InChI

InChI=1S/C15H19ClN2O4S/c1-15(2,3)13(20)18-14(23)17-10-7-11(21-4)8(6-9(10)16)12(19)22-5/h6-7H,1-5H3,(H2,17,18,20,23)