phenyl-[3,4,5-tris(propan-2-ylsulfanyl)pyridin-2-yl]methanone

Systemtic Name: phenyl-[3,4,5-tris(propan-2-ylsulfanyl)pyridin-2-yl]methanone Openeye Name: phenyl-[3,4,5-tris(isopropylsulfanyl)-2-pyridyl]methanone CAS Name: phenyl-[3,4,5-tris(propan-2-ylthio)-2-pyridinyl]methanone IUPAC Name: phenyl-[3,4,5-tris(propan-2-ylsulfanyl)pyridin-2-yl]methanone Traditional Name: phenyl-[3,4,5-tris(isopropylthio)-2-pyridyl]methanone Formula: C21H27NOS3 MolecularWeight: 405.64018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CN=C(C(=C1SC(C)C)SC(C)C)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)SC1=CN=C(C(=C1SC(C)C)SC(C)C)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H27NOS3/c1-13(2)24-17-12-22-18(19(23)16-10-8-7-9-11-16)21(26-15(5)6)20(17)25-14(3)4/h7-15H,1-6H3