S-[2-[methyl-(4-pentylphenyl)sulfonyl-amino]propyl] ethanethioate

Systemtic Name: S-[2-[methyl-(4-pentylphenyl)sulfonyl-amino]propyl] ethanethioate Openeye Name: S-[2-[methyl-(4-pentylphenyl)sulfonyl-amino]propyl] ethanethioate CAS Name: ethanethioic acid S-[2-[methyl-(4-pentylphenyl)sulfonylamino]propyl] ester IUPAC Name: S-[2-[methyl-(4-pentylphenyl)sulfonylamino]propyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[(4-amylphenyl)sulfonyl-methyl-amino]propyl] ester Formula: C17H27NO3S2 MolecularWeight: 357.53118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)N(C)C(C)CSC(=O)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)N(C)C(C)CSC(=O)C

InChI

InChI=1S/C17H27NO3S2/c1-5-6-7-8-16-9-11-17(12-10-16)23(20,21)18(4)14(2)13-22-15(3)19/h9-12,14H,5-8,13H2,1-4H3