(3,3-dimethyl-2-oxidanylidene-butyl) 2-[2-[(5-chloranylthiophen-2-yl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[2-[(5-chloranylthiophen-2-yl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[2-[(5-chloro-2-thienyl)methyl-methyl-amino]-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-[(5-chloro-2-thiophenyl)methyl-methylamino]-2-oxoethyl]thio]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[2-[(5-chlorothiophen-2-yl)methyl-methylamino]-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-[(5-chloro-2-thienyl)methyl-methyl-amino]-2-keto-ethyl]thio]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C21H24ClNO4S2 MolecularWeight: 454.00256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1SCC(=O)N(C)CC2=CC=C(S2)Cl

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1SCC(=O)N(C)CC2=CC=C(S2)Cl

InChI

InChI=1S/C21H24ClNO4S2/c1-21(2,3)17(24)12-27-20(26)15-7-5-6-8-16(15)28-13-19(25)23(4)11-14-9-10-18(22)29-14/h5-10H,11-13H2,1-4H3