2-(2-oxidanyl-3-phenylmethoxy-propyl)sulfanyl-4-phenyl-6-thiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-(2-oxidanyl-3-phenylmethoxy-propyl)sulfanyl-4-phenyl-6-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-(3-benzyloxy-2-hydroxy-propyl)sulfanyl-4-phenyl-6-(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[(2-hydroxy-3-phenylmethoxypropyl)thio]-4-phenyl-6-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-(2-hydroxy-3-phenylmethoxypropyl)sulfanyl-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[(3-benzoxy-2-hydroxy-propyl)thio]-4-phenyl-6-(2-thienyl)nicotinonitrile Formula: C26H22N2O2S2 MolecularWeight: 458.59508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=CC=C4)C#N)O

Isomeric SMILES

C1=CC=C(C=C1)COCC(CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=CC=C4)C#N)O

InChI

InChI=1S/C26H22N2O2S2/c27-15-23-22(20-10-5-2-6-11-20)14-24(25-12-7-13-31-25)28-26(23)32-18-21(29)17-30-16-19-8-3-1-4-9-19/h1-14,21,29H,16-18H2