(2S,3S)-3-(2-azanyl-5-propan-2-yl-phenyl)sulfanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanoic acid

Systemtic Name: (2S,3S)-3-(2-azanyl-5-propan-2-yl-phenyl)sulfanyl-3-(4-methoxyphenyl)-2-oxidanyl-propanoic acid Openeye Name: (2S,3S)-3-(2-amino-5-isopropyl-phenyl)sulfanyl-2-hydroxy-3-(4-methoxyphenyl)propanoic acid CAS Name: (2S,3S)-3-[(2-amino-5-propan-2-ylphenyl)thio]-2-hydroxy-3-(4-methoxyphenyl)propanoic acid IUPAC Name: (2S,3S)-3-(2-amino-5-propan-2-ylphenyl)sulfanyl-2-hydroxy-3-(4-methoxyphenyl)propanoic acid Traditional Name: (2S,3S)-3-[(2-amino-5-isopropyl-phenyl)thio]-2-hydroxy-3-(4-methoxyphenyl)propionic acid Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)N)SC(C2=CC=C(C=C2)OC)C(C(=O)O)O

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)N)S[C@@H](C2=CC=C(C=C2)OC)[C@H](C(=O)O)O

InChI

InChI=1S/C19H23NO4S/c1-11(2)13-6-9-15(20)16(10-13)25-18(17(21)19(22)23)12-4-7-14(24-3)8-5-12/h4-11,17-18,21H,20H2,1-3H3,(H,22,23)/t17-,18+/m1/s1