3,5-bis[(6-chloranylpyridin-3-yl)methylsulfanyl]-1,2-thiazole-4-carbonitrile

Systemtic Name: 3,5-bis[(6-chloranylpyridin-3-yl)methylsulfanyl]-1,2-thiazole-4-carbonitrile Openeye Name: 3,5-bis[(6-chloro-3-pyridyl)methylsulfanyl]isothiazole-4-carbonitrile CAS Name: 3,5-bis[(6-chloro-3-pyridinyl)methylthio]-4-isothiazolecarbonitrile IUPAC Name: 3,5-bis[(6-chloropyridin-3-yl)methylsulfanyl]-1,2-thiazole-4-carbonitrile Traditional Name: 3,5-bis[(6-chloro-3-pyridyl)methylthio]isothiazole-4-carbonitrile Formula: C16H10Cl2N4S3 MolecularWeight: 425.3784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1CSC2=C(C(=NS2)SCC3=CN=C(C=C3)Cl)C#N)Cl

Isomeric SMILES

C1=CC(=NC=C1CSC2=C(C(=NS2)SCC3=CN=C(C=C3)Cl)C#N)Cl

InChI

InChI=1S/C16H10Cl2N4S3/c17-13-3-1-10(6-20-13)8-23-15-12(5-19)16(25-22-15)24-9-11-2-4-14(18)21-7-11/h1-4,6-7H,8-9H2