ethyl 3-[5-[(4-chlorophenyl)sulfonylamino]pentylsulfanyl]-3-methyl-butanoate

Systemtic Name: ethyl 3-[5-[(4-chlorophenyl)sulfonylamino]pentylsulfanyl]-3-methyl-butanoate Openeye Name: ethyl 3-[5-[(4-chlorophenyl)sulfonylamino]pentylsulfanyl]-3-methyl-butanoate CAS Name: 3-[5-[(4-chlorophenyl)sulfonylamino]pentylthio]-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl 3-[5-[(4-chlorophenyl)sulfonylamino]pentylsulfanyl]-3-methylbutanoate Traditional Name: 3-[5-[(4-chlorophenyl)sulfonylamino]pentylthio]-3-methyl-butyric acid ethyl ester Formula: C18H28ClNO4S2 MolecularWeight: 422.00222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)(C)SCCCCCNS(=O)(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CCOC(=O)CC(C)(C)SCCCCCNS(=O)(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C18H28ClNO4S2/c1-4-24-17(21)14-18(2,3)25-13-7-5-6-12-20-26(22,23)16-10-8-15(19)9-11-16/h8-11,20H,4-7,12-14H2,1-3H3