2-[(6-chloranylpyridin-3-yl)methylsulfanyl]-6-methyl-4-thiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[(6-chloranylpyridin-3-yl)methylsulfanyl]-6-methyl-4-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[(6-chloro-3-pyridyl)methylsulfanyl]-6-methyl-4-(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[(6-chloro-3-pyridinyl)methylthio]-6-methyl-4-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[(6-chloropyridin-3-yl)methylsulfanyl]-6-methyl-4-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[(6-chloro-3-pyridyl)methylthio]-6-methyl-4-(2-thienyl)nicotinonitrile Formula: C17H12ClN3S2 MolecularWeight: 357.88028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C2=CC=CS2)C#N)SCC3=CN=C(C=C3)Cl

Isomeric SMILES

CC1=NC(=C(C(=C1)C2=CC=CS2)C#N)SCC3=CN=C(C=C3)Cl

InChI

InChI=1S/C17H12ClN3S2/c1-11-7-13(15-3-2-6-22-15)14(8-19)17(21-11)23-10-12-4-5-16(18)20-9-12/h2-7,9H,10H2,1H3