(2R)-2-acetamido-3-(3-bromophenyl)sulfanyl-N-(3-butoxypropyl)propanamide

Systemtic Name: (2R)-2-acetamido-3-(3-bromophenyl)sulfanyl-N-(3-butoxypropyl)propanamide Openeye Name: (2R)-2-acetamido-3-(3-bromophenyl)sulfanyl-N-(3-butoxypropyl)propanamide CAS Name: (2R)-2-acetamido-3-[(3-bromophenyl)thio]-N-(3-butoxypropyl)propanamide IUPAC Name: (2R)-2-acetamido-3-(3-bromophenyl)sulfanyl-N-(3-butoxypropyl)propanamide Traditional Name: (2R)-2-acetamido-3-[(3-bromophenyl)thio]-N-(3-butoxypropyl)propionamide Formula: C18H27BrN2O3S MolecularWeight: 431.38758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27BrN2O3S/c1-3-4-10-24-11-6-9-20-18(23)17(21-14(2)22)13-25-16-8-5-7-15(19)12-16/h5,7-8,12,17H,3-4,6,9-11,13H2,1-2H3,(H,20,23)(H,21,22)/t17-/m0/s1