methyl N-[2-[3-(phenylmethyl)sulfonylpropanoylamino]thiophen-3-yl]carbonylcarbamate

Systemtic Name: methyl N-[2-[3-(phenylmethyl)sulfonylpropanoylamino]thiophen-3-yl]carbonylcarbamate Openeye Name: methyl N-[2-(3-benzylsulfonylpropanoylamino)thiophene-3-carbonyl]carbamate CAS Name: N-[oxo-[2-[[1-oxo-3-(phenylmethyl)sulfonylpropyl]amino]-3-thiophenyl]methyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-(3-benzylsulfonylpropanoylamino)thiophene-3-carbonyl]carbamate Traditional Name: N-[2-(3-benzylsulfonylpropanoylamino)thiophene-3-carbonyl]carbamic acid methyl ester Formula: C17H18N2O6S2 MolecularWeight: 410.46462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=O)C1=C(SC=C1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)NC(=O)C1=C(SC=C1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C17H18N2O6S2/c1-25-17(22)19-15(21)13-7-9-26-16(13)18-14(20)8-10-27(23,24)11-12-5-3-2-4-6-12/h2-7,9H,8,10-11H2,1H3,(H,18,20)(H,19,21,22)