methyl N-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanoyl]carbamate

Systemtic Name: methyl N-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanoyl]carbamate Openeye Name: methyl N-[2-[4-(2-thienylsulfonyl)piperazin-1-yl]acetyl]carbamate CAS Name: N-[1-oxo-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)acetyl]carbamate Traditional Name: N-[2-[4-(2-thienylsulfonyl)piperazino]acetyl]carbamic acid methyl ester Formula: C12H17N3O5S2 MolecularWeight: 347.41048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

COC(=O)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C12H17N3O5S2/c1-20-12(17)13-10(16)9-14-4-6-15(7-5-14)22(18,19)11-3-2-8-21-11/h2-3,8H,4-7,9H2,1H3,(H,13,16,17)