2-pyridin-4-ylethyl N-butylcarbamodithioate

Systemtic Name: 2-pyridin-4-ylethyl N-butylcarbamodithioate Openeye Name: 2-(4-pyridyl)ethyl N-butylcarbamodithioate CAS Name: N-butylcarbamodithioic acid 2-pyridin-4-ylethyl ester IUPAC Name: 2-pyridin-4-ylethyl N-butylcarbamodithioate Traditional Name: N-butylcarbamodithioic acid 2-(4-pyridyl)ethyl ester Formula: C12H18N2S2 MolecularWeight: 254.41472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)SCCC1=CC=NC=C1

Isomeric SMILES

CCCCNC(=S)SCCC1=CC=NC=C1

InChI

InChI=1S/C12H18N2S2/c1-2-3-7-14-12(15)16-10-6-11-4-8-13-9-5-11/h4-5,8-9H,2-3,6-7,10H2,1H3,(H,14,15)