4,6-bis(4-methoxyphenyl)-2-phenacylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4,6-bis(4-methoxyphenyl)-2-phenacylsulfanyl-pyridine-3-carbonitrile Openeye Name: 4,6-bis(4-methoxyphenyl)-2-phenacylsulfanyl-pyridine-3-carbonitrile CAS Name: 4,6-bis(4-methoxyphenyl)-2-(phenacylthio)-3-pyridinecarbonitrile IUPAC Name: 4,6-bis(4-methoxyphenyl)-2-phenacylsulfanylpyridine-3-carbonitrile Traditional Name: 4,6-bis(4-methoxyphenyl)-2-(phenacylthio)nicotinonitrile Formula: C28H22N2O3S MolecularWeight: 466.55088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C28H22N2O3S/c1-32-22-12-8-19(9-13-22)24-16-26(20-10-14-23(33-2)15-11-20)30-28(25(24)17-29)34-18-27(31)21-6-4-3-5-7-21/h3-16H,18H2,1-2H3