N-[1-[2-(2-hydroxyphenyl)-4-methylsulfanyl-3-propan-2-ylsulfonyl-phenyl]-3-oxidanylidene-propyl]methanamide

Systemtic Name: N-[1-[2-(2-hydroxyphenyl)-4-methylsulfanyl-3-propan-2-ylsulfonyl-phenyl]-3-oxidanylidene-propyl]methanamide Openeye Name: N-[1-[2-(2-hydroxyphenyl)-3-isopropylsulfonyl-4-methylsulfanyl-phenyl]-3-oxo-propyl]formamide CAS Name: N-[1-[2-(2-hydroxyphenyl)-4-(methylthio)-3-propan-2-ylsulfonylphenyl]-3-oxopropyl]formamide IUPAC Name: N-[1-[2-(2-hydroxyphenyl)-4-methylsulfanyl-3-propan-2-ylsulfonylphenyl]-3-oxopropyl]formamide Traditional Name: N-[1-[2-(2-hydroxyphenyl)-3-isopropylsulfonyl-4-(methylthio)phenyl]-3-keto-propyl]formamide Formula: C20H23NO5S2 MolecularWeight: 421.53032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C=CC(=C1C2=CC=CC=C2O)C(CC=O)NC=O)SC

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C=CC(=C1C2=CC=CC=C2O)C(CC=O)NC=O)SC

InChI

InChI=1S/C20H23NO5S2/c1-13(2)28(25,26)20-18(27-3)9-8-14(16(10-11-22)21-12-23)19(20)15-6-4-5-7-17(15)24/h4-9,11-13,16,24H,10H2,1-3H3,(H,21,23)