(2S,3S)-2-(phenylmethyl)-3-[(5-phenylthiophen-3-yl)methyl]butanedioic acid

Systemtic Name: (2S,3S)-2-(phenylmethyl)-3-[(5-phenylthiophen-3-yl)methyl]butanedioic acid Openeye Name: (2S,3S)-2-benzyl-3-[(5-phenyl-3-thienyl)methyl]butanedioic acid CAS Name: (2S,3S)-2-(phenylmethyl)-3-[(5-phenyl-3-thiophenyl)methyl]butanedioic acid IUPAC Name: (2S,3S)-2-benzyl-3-[(5-phenylthiophen-3-yl)methyl]butanedioic acid Traditional Name: (2S,3S)-2-benzyl-3-[(5-phenyl-3-thienyl)methyl]succinic acid Formula: C22H20O4S MolecularWeight: 380.4568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(CC2=CSC(=C2)C3=CC=CC=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H]([C@H](CC2=CSC(=C2)C3=CC=CC=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C22H20O4S/c23-21(24)18(11-15-7-3-1-4-8-15)19(22(25)26)12-16-13-20(27-14-16)17-9-5-2-6-10-17/h1-10,13-14,18-19H,11-12H2,(H,23,24)(H,25,26)/t18-,19-/m0/s1