methyl N-[2-[4-(phenylsulfonyl)butanoylamino]thiophen-3-yl]carbonylcarbamate

Systemtic Name: methyl N-[2-[4-(phenylsulfonyl)butanoylamino]thiophen-3-yl]carbonylcarbamate Openeye Name: methyl N-[2-[4-(benzenesulfonyl)butanoylamino]thiophene-3-carbonyl]carbamate CAS Name: N-[[2-[[4-(benzenesulfonyl)-1-oxobutyl]amino]-3-thiophenyl]-oxomethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[4-(benzenesulfonyl)butanoylamino]thiophene-3-carbonyl]carbamate Traditional Name: N-[2-(4-besylbutanoylamino)thiophene-3-carbonyl]carbamic acid methyl ester Formula: C17H18N2O6S2 MolecularWeight: 410.46462

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=O)C1=C(SC=C1)NC(=O)CCCS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)NC(=O)C1=C(SC=C1)NC(=O)CCCS(=O)(=O)C2=CC=CC=C2

InChI

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