4,5,6-trimethyl-2-[[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]pyridine-3-carbonitrile

Systemtic Name: 4,5,6-trimethyl-2-[[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]pyridine-3-carbonitrile Openeye Name: 2-[[2-(4-isopropylphenyl)thiazol-4-yl]methylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile CAS Name: 4,5,6-trimethyl-2-[[2-(4-propan-2-ylphenyl)-4-thiazolyl]methylthio]-3-pyridinecarbonitrile IUPAC Name: 4,5,6-trimethyl-2-[[2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]pyridine-3-carbonitrile Traditional Name: 4,5,6-trimethyl-2-[(2-p-cumenylthiazol-4-yl)methylthio]nicotinonitrile Formula: C22H23N3S2 MolecularWeight: 393.56812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCC2=CSC(=N2)C3=CC=C(C=C3)C(C)C)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCC2=CSC(=N2)C3=CC=C(C=C3)C(C)C)C

InChI

InChI=1S/C22H23N3S2/c1-13(2)17-6-8-18(9-7-17)21-25-19(11-26-21)12-27-22-20(10-23)15(4)14(3)16(5)24-22/h6-9,11,13H,12H2,1-5H3