(2S)-2-acetamido-3-(3-bromophenyl)sulfanyl-N-cyclopentyl-propanamide

Systemtic Name: (2S)-2-acetamido-3-(3-bromophenyl)sulfanyl-N-cyclopentyl-propanamide Openeye Name: (2S)-2-acetamido-3-(3-bromophenyl)sulfanyl-N-cyclopentyl-propanamide CAS Name: (2S)-2-acetamido-3-[(3-bromophenyl)thio]-N-cyclopentylpropanamide IUPAC Name: (2S)-2-acetamido-3-(3-bromophenyl)sulfanyl-N-cyclopentylpropanamide Traditional Name: (2S)-2-acetamido-3-[(3-bromophenyl)thio]-N-cyclopentyl-propionamide Formula: C16H21BrN2O2S MolecularWeight: 385.31914

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1=CC(=CC=C1)Br)C(=O)NC2CCCC2

Isomeric SMILES

CC(=O)N[C@H](CSC1=CC(=CC=C1)Br)C(=O)NC2CCCC2

InChI

InChI=1S/C16H21BrN2O2S/c1-11(20)18-15(16(21)19-13-6-2-3-7-13)10-22-14-8-4-5-12(17)9-14/h4-5,8-9,13,15H,2-3,6-7,10H2,1H3,(H,18,20)(H,19,21)/t15-/m1/s1