S-[4-(4-dimethylaminophenyl)butyl] ethanethioate

Systemtic Name: S-[4-(4-dimethylaminophenyl)butyl] ethanethioate Openeye Name: S-[4-(4-dimethylaminophenyl)butyl] ethanethioate CAS Name: ethanethioic acid S-[4-(4-dimethylaminophenyl)butyl] ester IUPAC Name: S-[4-(4-dimethylaminophenyl)butyl] ethanethioate Traditional Name: ethanethioic acid S-[4-(4-dimethylaminophenyl)butyl] ester Formula: C14H21NOS MolecularWeight: 251.38764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCCCC1=CC=C(C=C1)N(C)C

Isomeric SMILES

CC(=O)SCCCCC1=CC=C(C=C1)N(C)C

InChI

InChI=1S/C14H21NOS/c1-12(16)17-11-5-4-6-13-7-9-14(10-8-13)15(2)3/h7-10H,4-6,11H2,1-3H3