(2R)-2-acetamido-N-(3-morpholin-4-ylpropyl)-3-(4-propan-2-ylphenyl)sulfanyl-propanamide

Systemtic Name: (2R)-2-acetamido-N-(3-morpholin-4-ylpropyl)-3-(4-propan-2-ylphenyl)sulfanyl-propanamide Openeye Name: (2R)-2-acetamido-3-(4-isopropylphenyl)sulfanyl-N-(3-morpholinopropyl)propanamide CAS Name: (2R)-2-acetamido-N-[3-(4-morpholinyl)propyl]-3-[(4-propan-2-ylphenyl)thio]propanamide IUPAC Name: (2R)-2-acetamido-N-(3-morpholin-4-ylpropyl)-3-(4-propan-2-ylphenyl)sulfanylpropanamide Traditional Name: (2R)-2-acetamido-N-(3-morpholinopropyl)-3-(p-cumenylthio)propionamide Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)SCC(C(=O)NCCCN2CCOCC2)NC(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)SC[C@@H](C(=O)NCCCN2CCOCC2)NC(=O)C

InChI

InChI=1S/C21H33N3O3S/c1-16(2)18-5-7-19(8-6-18)28-15-20(23-17(3)25)21(26)22-9-4-10-24-11-13-27-14-12-24/h5-8,16,20H,4,9-15H2,1-3H3,(H,22,26)(H,23,25)/t20-/m0/s1