4-(4-tert-butylphenyl)-2-phenacylsulfanyl-6-phenyl-pyridine-3-carbonitrile

Systemtic Name: 4-(4-tert-butylphenyl)-2-phenacylsulfanyl-6-phenyl-pyridine-3-carbonitrile Openeye Name: 4-(4-tert-butylphenyl)-2-phenacylsulfanyl-6-phenyl-pyridine-3-carbonitrile CAS Name: 4-(4-tert-butylphenyl)-2-(phenacylthio)-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 4-(4-tert-butylphenyl)-2-phenacylsulfanyl-6-phenylpyridine-3-carbonitrile Traditional Name: 4-(4-tert-butylphenyl)-2-(phenacylthio)-6-phenyl-nicotinonitrile Formula: C30H26N2OS MolecularWeight: 462.60524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H26N2OS/c1-30(2,3)24-16-14-21(15-17-24)25-18-27(22-10-6-4-7-11-22)32-29(26(25)19-31)34-20-28(33)23-12-8-5-9-13-23/h4-18H,20H2,1-3H3