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

Systemtic Name: (2R)-2-acetamido-N-(3-butoxypropyl)-3-(4-propan-2-ylphenyl)sulfanyl-propanamide Openeye Name: (2R)-2-acetamido-N-(3-butoxypropyl)-3-(4-isopropylphenyl)sulfanyl-propanamide CAS Name: (2R)-2-acetamido-N-(3-butoxypropyl)-3-[(4-propan-2-ylphenyl)thio]propanamide IUPAC Name: (2R)-2-acetamido-N-(3-butoxypropyl)-3-(4-propan-2-ylphenyl)sulfanylpropanamide Traditional Name: (2R)-2-acetamido-N-(3-butoxypropyl)-3-(p-cumenylthio)propionamide Formula: C21H34N2O3S MolecularWeight: 394.57126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34N2O3S/c1-5-6-13-26-14-7-12-22-21(25)20(23-17(4)24)15-27-19-10-8-18(9-11-19)16(2)3/h8-11,16,20H,5-7,12-15H2,1-4H3,(H,22,25)(H,23,24)/t20-/m0/s1