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2-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-6-pyridin-3-yl-pyridine-3-carbonitrile

2-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-6-pyridin-3-yl-pyridine-3-carbonitrile

Systemtic Name:2-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-6-pyridin-3-yl-pyridine-3-carbonitrile
Openeye Name:2-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-6-(3-pyridyl)pyridine-3-carbonitrile
CAS Name:2-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]-6-(3-pyridinyl)-3-pyridinecarbonitrile
IUPAC Name:2-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-6-pyridin-3-ylpyridine-3-carbonitrile
Traditional Name:2-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]-6-(3-pyridyl)nicotinonitrile
Formula: C19H12ClN3O2S
MolecularWeight: 381.83548
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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CSC3=C(C=CC(=N3)C4=CN=CC=C4)C#N)Cl


Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CSC3=C(C=CC(=N3)C4=CN=CC=C4)C#N)Cl


InChI

InChI=1S/C19H12ClN3O2S/c20-15-7-18-17(24-11-25-18)6-14(15)10-26-19-12(8-21)3-4-16(23-19)13-2-1-5-22-9-13/h1-7,9H,10-11H2


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