4,6-diphenyl-2-prop-2-ynylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4,6-diphenyl-2-prop-2-ynylsulfanyl-pyridine-3-carbonitrile Openeye Name: 4,6-diphenyl-2-prop-2-ynylsulfanyl-pyridine-3-carbonitrile CAS Name: 4,6-diphenyl-2-(prop-2-ynylthio)-3-pyridinecarbonitrile IUPAC Name: 4,6-diphenyl-2-prop-2-ynylsulfanylpyridine-3-carbonitrile Traditional Name: 4,6-diphenyl-2-(propargylthio)nicotinonitrile Formula: C21H14N2S MolecularWeight: 326.41426

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Descriptors Computed from Structure

Canonical SMILES:

C#CCSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

C#CCSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C21H14N2S/c1-2-13-24-21-19(15-22)18(16-9-5-3-6-10-16)14-20(23-21)17-11-7-4-8-12-17/h1,3-12,14H,13H2