[2-(butylamino)-2-(2-chlorophenyl)ethyl]carbamodithioic acid

Systemtic Name: [2-(butylamino)-2-(2-chlorophenyl)ethyl]carbamodithioic acid Openeye Name: [2-(butylamino)-2-(2-chlorophenyl)ethyl]carbamodithioic acid CAS Name: [2-(butylamino)-2-(2-chlorophenyl)ethyl]carbamodithioic acid IUPAC Name: [2-(butylamino)-2-(2-chlorophenyl)ethyl]carbamodithioic acid Traditional Name: [2-(butylamino)-2-(2-chlorophenyl)ethyl]carbamodithioic acid Formula: C13H19ClN2S2 MolecularWeight: 302.88636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(CNC(=S)S)C1=CC=CC=C1Cl

Isomeric SMILES

CCCCNC(CNC(=S)S)C1=CC=CC=C1Cl

InChI

InChI=1S/C13H19ClN2S2/c1-2-3-8-15-12(9-16-13(17)18)10-6-4-5-7-11(10)14/h4-7,12,15H,2-3,8-9H2,1H3,(H2,16,17,18)