[5-[2-(3,4-dichlorophenyl)butyl-methyl-carbamoyl]thiophen-3-yl] methanesulfonate

Systemtic Name: [5-[2-(3,4-dichlorophenyl)butyl-methyl-carbamoyl]thiophen-3-yl] methanesulfonate Openeye Name: [5-[2-(3,4-dichlorophenyl)butyl-methyl-carbamoyl]-3-thienyl] methanesulfonate CAS Name: methanesulfonic acid [5-[[2-(3,4-dichlorophenyl)butyl-methylamino]-oxomethyl]-3-thiophenyl] ester IUPAC Name: [5-[2-(3,4-dichlorophenyl)butyl-methylcarbamoyl]thiophen-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [5-[2-(3,4-dichlorophenyl)butyl-methyl-carbamoyl]-3-thienyl] ester Formula: C17H19Cl2NO4S2 MolecularWeight: 436.37306

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN(C)C(=O)C1=CC(=CS1)OS(=O)(=O)C)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCC(CN(C)C(=O)C1=CC(=CS1)OS(=O)(=O)C)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H19Cl2NO4S2/c1-4-11(12-5-6-14(18)15(19)7-12)9-20(2)17(21)16-8-13(10-25-16)24-26(3,22)23/h5-8,10-11H,4,9H2,1-3H3