(2R)-2-acetamido-3-(3-nitrophenyl)sulfanyl-N-[(1R)-1-phenylethyl]propanamide

Systemtic Name: (2R)-2-acetamido-3-(3-nitrophenyl)sulfanyl-N-[(1R)-1-phenylethyl]propanamide Openeye Name: (2R)-2-acetamido-3-(3-nitrophenyl)sulfanyl-N-[(1R)-1-phenylethyl]propanamide CAS Name: (2R)-2-acetamido-3-[(3-nitrophenyl)thio]-N-[(1R)-1-phenylethyl]propanamide IUPAC Name: (2R)-2-acetamido-3-(3-nitrophenyl)sulfanyl-N-[(1R)-1-phenylethyl]propanamide Traditional Name: (2R)-2-acetamido-3-[(3-nitrophenyl)thio]-N-[(1R)-1-phenylethyl]propionamide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(CSC2=CC=CC(=C2)[N+](=O)[O-])NC(=O)C

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)[C@H](CSC2=CC=CC(=C2)[N+](=O)[O-])NC(=O)C

InChI

InChI=1S/C19H21N3O4S/c1-13(15-7-4-3-5-8-15)20-19(24)18(21-14(2)23)12-27-17-10-6-9-16(11-17)22(25)26/h3-11,13,18H,12H2,1-2H3,(H,20,24)(H,21,23)/t13-,18+/m1/s1