(2R)-2-acetamido-3-(3-bromophenyl)sulfanyl-N-[(2R)-2-oxidanylpropyl]propanamide

Systemtic Name: (2R)-2-acetamido-3-(3-bromophenyl)sulfanyl-N-[(2R)-2-oxidanylpropyl]propanamide Openeye Name: (2R)-2-acetamido-3-(3-bromophenyl)sulfanyl-N-[(2R)-2-hydroxypropyl]propanamide CAS Name: (2R)-2-acetamido-3-[(3-bromophenyl)thio]-N-[(2R)-2-hydroxypropyl]propanamide IUPAC Name: (2R)-2-acetamido-3-(3-bromophenyl)sulfanyl-N-[(2R)-2-hydroxypropyl]propanamide Traditional Name: (2R)-2-acetamido-3-[(3-bromophenyl)thio]-N-[(2R)-2-hydroxypropyl]propionamide Formula: C14H19BrN2O3S MolecularWeight: 375.28126

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C(CSC1=CC(=CC=C1)Br)NC(=O)C)O

Isomeric SMILES

C[C@H](CNC(=O)[C@H](CSC1=CC(=CC=C1)Br)NC(=O)C)O

InChI

InChI=1S/C14H19BrN2O3S/c1-9(18)7-16-14(20)13(17-10(2)19)8-21-12-5-3-4-11(15)6-12/h3-6,9,13,18H,7-8H2,1-2H3,(H,16,20)(H,17,19)/t9-,13+/m1/s1