3-(4-chlorophenyl)propyl-ethyl-carbamothioic S-acid

Systemtic Name: 3-(4-chlorophenyl)propyl-ethyl-carbamothioic S-acid Openeye Name: 3-(4-chlorophenyl)propyl-ethyl-carbamothioic S-acid CAS Name: 3-(4-chlorophenyl)propyl-ethylcarbamothioic S-acid IUPAC Name: 3-(4-chlorophenyl)propyl-ethylcarbamothioic S-acid Traditional Name: 3-(4-chlorophenyl)propyl-ethyl-thiocarbamic S-acid Formula: C12H16ClNOS MolecularWeight: 257.77954

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC1=CC=C(C=C1)Cl)C(=O)S

Isomeric SMILES

CCN(CCCC1=CC=C(C=C1)Cl)C(=O)S

InChI

InChI=1S/C12H16ClNOS/c1-2-14(12(15)16)9-3-4-10-5-7-11(13)8-6-10/h5-8H,2-4,9H2,1H3,(H,15,16)