2-[bis(4-methylthiophen-2-yl)methyl]-3-oxidanyl-2-phenoxy-butanoic acid

Systemtic Name: 2-[bis(4-methylthiophen-2-yl)methyl]-3-oxidanyl-2-phenoxy-butanoic acid Openeye Name: 2-[bis(4-methyl-2-thienyl)methyl]-3-hydroxy-2-phenoxy-butanoic acid CAS Name: 2-[bis(4-methyl-2-thiophenyl)methyl]-3-hydroxy-2-phenoxybutanoic acid IUPAC Name: 2-[bis(4-methylthiophen-2-yl)methyl]-3-hydroxy-2-phenoxybutanoic acid Traditional Name: 2-[bis(4-methyl-2-thienyl)methyl]-3-hydroxy-2-phenoxy-butyric acid Formula: C21H22O4S2 MolecularWeight: 402.52698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C(C2=CC(=CS2)C)C(C(C)O)(C(=O)O)OC3=CC=CC=C3

Isomeric SMILES

CC1=CSC(=C1)C(C2=CC(=CS2)C)C(C(C)O)(C(=O)O)OC3=CC=CC=C3

InChI

InChI=1S/C21H22O4S2/c1-13-9-17(26-11-13)19(18-10-14(2)12-27-18)21(15(3)22,20(23)24)25-16-7-5-4-6-8-16/h4-12,15,19,22H,1-3H3,(H,23,24)