2-[(4-carbamothioylphenyl)methylsulfonyl-methyl-amino]-N-methyl-ethanamide

Systemtic Name: 2-[(4-carbamothioylphenyl)methylsulfonyl-methyl-amino]-N-methyl-ethanamide Openeye Name: 2-[(4-carbamothioylphenyl)methylsulfonyl-methyl-amino]-N-methyl-acetamide CAS Name: 2-[(4-carbamothioylphenyl)methylsulfonyl-methylamino]-N-methylacetamide IUPAC Name: 2-[(4-carbamothioylphenyl)methylsulfonyl-methylamino]-N-methylacetamide Traditional Name: N-methyl-2-[methyl-(4-thiocarbamoylbenzyl)sulfonyl-amino]acetamide Formula: C12H17N3O3S2 MolecularWeight: 315.41168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN(C)S(=O)(=O)CC1=CC=C(C=C1)C(=S)N

Isomeric SMILES

CNC(=O)CN(C)S(=O)(=O)CC1=CC=C(C=C1)C(=S)N

InChI

InChI=1S/C12H17N3O3S2/c1-14-11(16)7-15(2)20(17,18)8-9-3-5-10(6-4-9)12(13)19/h3-6H,7-8H2,1-2H3,(H2,13,19)(H,14,16)