3-(2-pyridin-4-ylethyl)-1,3-benzothiazole-2-thione

Systemtic Name: 3-(2-pyridin-4-ylethyl)-1,3-benzothiazole-2-thione Openeye Name: 3-[2-(4-pyridyl)ethyl]-1,3-benzothiazole-2-thione CAS Name: 3-(2-pyridin-4-ylethyl)-1,3-benzothiazole-2-thione IUPAC Name: 3-(2-pyridin-4-ylethyl)-1,3-benzothiazole-2-thione Traditional Name: 3-[2-(4-pyridyl)ethyl]-1,3-benzothiazole-2-thione Formula: C14H12N2S2 MolecularWeight: 272.38848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=S)S2)CCC3=CC=NC=C3

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=S)S2)CCC3=CC=NC=C3

InChI

InChI=1S/C14H12N2S2/c17-14-16(10-7-11-5-8-15-9-6-11)12-3-1-2-4-13(12)18-14/h1-6,8-9H,7,10H2