[4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] 2-propan-2-ylsulfanylethanoate

Systemtic Name: [4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] 2-propan-2-ylsulfanylethanoate Openeye Name: [4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] 2-isopropylsulfanylacetate CAS Name: 2-(propan-2-ylthio)acetic acid [4-[(4-chlorophenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(4-chlorophenyl)sulfonyl-methylamino]phenyl] 2-propan-2-ylsulfanylacetate Traditional Name: 2-(isopropylthio)acetic acid [4-[(4-chlorophenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C18H20ClNO4S2 MolecularWeight: 413.9387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC(=O)OC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)SCC(=O)OC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H20ClNO4S2/c1-13(2)25-12-18(21)24-16-8-6-15(7-9-16)20(3)26(22,23)17-10-4-14(19)5-11-17/h4-11,13H,12H2,1-3H3