(2R)-2-[(2R)-2-acetamidopropanoyl]sulfanyl-3-dibenzofuran-2-yl-propanoic acid

Systemtic Name: (2R)-2-[(2R)-2-acetamidopropanoyl]sulfanyl-3-dibenzofuran-2-yl-propanoic acid Openeye Name: (2R)-2-[(2R)-2-acetamidopropanoyl]sulfanyl-3-dibenzofuran-2-yl-propanoic acid CAS Name: (2R)-2-[[(2R)-2-acetamido-1-oxopropyl]thio]-3-(2-dibenzofuranyl)propanoic acid IUPAC Name: (2R)-2-[(2R)-2-acetamidopropanoyl]sulfanyl-3-dibenzofuran-2-ylpropanoic acid Traditional Name: (2R)-2-[[(2R)-2-acetamidopropanoyl]thio]-3-dibenzofuran-2-yl-propionic acid Formula: C20H19NO5S MolecularWeight: 385.43356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)SC(CC1=CC2=C(C=C1)OC3=CC=CC=C32)C(=O)O)NC(=O)C

Isomeric SMILES

C[C@H](C(=O)S[C@H](CC1=CC2=C(C=C1)OC3=CC=CC=C32)C(=O)O)NC(=O)C

InChI

InChI=1S/C20H19NO5S/c1-11(21-12(2)22)20(25)27-18(19(23)24)10-13-7-8-17-15(9-13)14-5-3-4-6-16(14)26-17/h3-9,11,18H,10H2,1-2H3,(H,21,22)(H,23,24)/t11-,18-/m1/s1