2-chloranyl-5-[2-(pyridin-4-ylmethyl)pyridin-3-yl]sulfanyl-pyridine

Systemtic Name: 2-chloranyl-5-[2-(pyridin-4-ylmethyl)pyridin-3-yl]sulfanyl-pyridine Openeye Name: 2-chloro-5-[[2-(4-pyridylmethyl)-3-pyridyl]sulfanyl]pyridine CAS Name: 2-chloro-5-[[2-(pyridin-4-ylmethyl)-3-pyridinyl]thio]pyridine IUPAC Name: 2-chloro-5-[2-(pyridin-4-ylmethyl)pyridin-3-yl]sulfanylpyridine Traditional Name: 2-chloro-5-[[2-(4-pyridylmethyl)-3-pyridyl]thio]pyridine Formula: C16H12ClN3S MolecularWeight: 313.80458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)CC2=CC=NC=C2)SC3=CN=C(C=C3)Cl

Isomeric SMILES

C1=CC(=C(N=C1)CC2=CC=NC=C2)SC3=CN=C(C=C3)Cl

InChI

InChI=1S/C16H12ClN3S/c17-16-4-3-13(11-20-16)21-15-2-1-7-19-14(15)10-12-5-8-18-9-6-12/h1-9,11H,10H2