4-(4-chlorophenyl)-2-[(2S)-pentan-2-yl]sulfanyl-6-thiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 4-(4-chlorophenyl)-2-[(2S)-pentan-2-yl]sulfanyl-6-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 4-(4-chlorophenyl)-2-[(1S)-1-methylbutyl]sulfanyl-6-(2-thienyl)pyridine-3-carbonitrile CAS Name: 4-(4-chlorophenyl)-2-[[(2S)-pentan-2-yl]thio]-6-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 4-(4-chlorophenyl)-2-[(2S)-pentan-2-yl]sulfanyl-6-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 4-(4-chlorophenyl)-2-[[(1S)-1-methylbutyl]thio]-6-(2-thienyl)nicotinonitrile Formula: C21H19ClN2S2 MolecularWeight: 398.97196

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)SC1=C(C(=CC(=N1)C2=CC=CS2)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CCC[C@H](C)SC1=C(C(=CC(=N1)C2=CC=CS2)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C21H19ClN2S2/c1-3-5-14(2)26-21-18(13-23)17(15-7-9-16(22)10-8-15)12-19(24-21)20-6-4-11-25-20/h4,6-12,14H,3,5H2,1-2H3/t14-/m0/s1