methyl 2-[(4-carbamothioylphenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: methyl 2-[(4-carbamothioylphenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: methyl 2-[(4-carbamothioylphenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-carbamothioylphenyl)sulfonyl-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[(4-carbamothioylphenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[methyl-(4-thiocarbamoylphenyl)sulfonyl-amino]acetic acid methyl ester Formula: C11H14N2O4S2 MolecularWeight: 302.36986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)S(=O)(=O)C1=CC=C(C=C1)C(=S)N

Isomeric SMILES

CN(CC(=O)OC)S(=O)(=O)C1=CC=C(C=C1)C(=S)N

InChI

InChI=1S/C11H14N2O4S2/c1-13(7-10(14)17-2)19(15,16)9-5-3-8(4-6-9)11(12)18/h3-6H,7H2,1-2H3,(H2,12,18)