6-(4-nitrophenyl)-3-(2-propan-2-ylphenyl)sulfanyl-pyran-2-one

Systemtic Name: 6-(4-nitrophenyl)-3-(2-propan-2-ylphenyl)sulfanyl-pyran-2-one Openeye Name: 3-(2-isopropylphenyl)sulfanyl-6-(4-nitrophenyl)pyran-2-one CAS Name: 6-(4-nitrophenyl)-3-[(2-propan-2-ylphenyl)thio]-2-pyranone IUPAC Name: 6-(4-nitrophenyl)-3-(2-propan-2-ylphenyl)sulfanylpyran-2-one Traditional Name: 6-(4-nitrophenyl)-3-(o-cumenylthio)pyran-2-one Formula: C20H17NO4S MolecularWeight: 367.41828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=CC=C(OC2=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=CC=C(OC2=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17NO4S/c1-13(2)16-5-3-4-6-18(16)26-19-12-11-17(25-20(19)22)14-7-9-15(10-8-14)21(23)24/h3-13H,1-2H3