3-[(4-chlorophenyl)-methyl-amino]-3-sulfanylidene-propanoic acid

Systemtic Name: 3-[(4-chlorophenyl)-methyl-amino]-3-sulfanylidene-propanoic acid Openeye Name: 3-(4-chloro-N-methyl-anilino)-3-thioxo-propanoic acid CAS Name: 3-(4-chloro-N-methylanilino)-3-sulfanylidenepropanoic acid IUPAC Name: 3-(4-chloro-N-methylanilino)-3-sulfanylidenepropanoic acid Traditional Name: 3-(4-chloro-N-methyl-anilino)-3-thioxo-propionic acid Formula: C10H10ClNO2S MolecularWeight: 243.7099

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)Cl)C(=S)CC(=O)O

Isomeric SMILES

CN(C1=CC=C(C=C1)Cl)C(=S)CC(=O)O

InChI

InChI=1S/C10H10ClNO2S/c1-12(9(15)6-10(13)14)8-4-2-7(11)3-5-8/h2-5H,6H2,1H3,(H,13,14)