3-(ethanoylcarbamothioylamino)-4-methoxy-benzoate

Systemtic Name: 3-(ethanoylcarbamothioylamino)-4-methoxy-benzoate Openeye Name: 3-(acetylcarbamothioylamino)-4-methoxy-benzoate CAS Name: 3-[[acetamido(sulfanylidene)methyl]amino]-4-methoxybenzoate IUPAC Name: 3-(acetylcarbamothioylamino)-4-methoxybenzoate Traditional Name: 3-(acetylthiocarbamoylamino)-4-methoxy-benzoate Formula: C11H11N2O4S- MolecularWeight: 267.28104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=S)NC1=C(C=CC(=C1)C(=O)[O-])OC

Isomeric SMILES

CC(=O)NC(=S)NC1=C(C=CC(=C1)C(=O)[O-])OC

InChI

InChI=1S/C11H12N2O4S/c1-6(14)12-11(18)13-8-5-7(10(15)16)3-4-9(8)17-2/h3-5H,1-2H3,(H,15,16)(H2,12,13,14,18)/p-1