3-azanyl-N-(4-methylsulfonylphenyl)-3-sulfanylidene-propanamide

Systemtic Name: 3-azanyl-N-(4-methylsulfonylphenyl)-3-sulfanylidene-propanamide Openeye Name: 3-amino-N-(4-methylsulfonylphenyl)-3-thioxo-propanamide CAS Name: 3-amino-N-(4-methylsulfonylphenyl)-3-sulfanylidenepropanamide IUPAC Name: 3-amino-N-(4-methylsulfonylphenyl)-3-sulfanylidenepropanamide Traditional Name: 3-amino-N-(4-mesylphenyl)-3-thioxo-propionamide Formula: C10H12N2O3S2 MolecularWeight: 272.34388

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CC(=S)N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CC(=S)N

InChI

InChI=1S/C10H12N2O3S2/c1-17(14,15)8-4-2-7(3-5-8)12-10(13)6-9(11)16/h2-5H,6H2,1H3,(H2,11,16)(H,12,13)