(2S)-2-acetamido-3-(4-butylphenyl)sulfanyl-N-ethyl-N-(2-hydroxyethyl)propanamide

Systemtic Name: (2S)-2-acetamido-3-(4-butylphenyl)sulfanyl-N-ethyl-N-(2-hydroxyethyl)propanamide Openeye Name: (2S)-2-acetamido-3-(4-butylphenyl)sulfanyl-N-ethyl-N-(2-hydroxyethyl)propanamide CAS Name: (2S)-2-acetamido-3-[(4-butylphenyl)thio]-N-ethyl-N-(2-hydroxyethyl)propanamide IUPAC Name: (2S)-2-acetamido-3-(4-butylphenyl)sulfanyl-N-ethyl-N-(2-hydroxyethyl)propanamide Traditional Name: (2S)-2-acetamido-3-[(4-butylphenyl)thio]-N-ethyl-N-(2-hydroxyethyl)propionamide Formula: C19H30N2O3S MolecularWeight: 366.5181

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)SCC(C(=O)N(CC)CCO)NC(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)SC[C@H](C(=O)N(CC)CCO)NC(=O)C

InChI

InChI=1S/C19H30N2O3S/c1-4-6-7-16-8-10-17(11-9-16)25-14-18(20-15(3)23)19(24)21(5-2)12-13-22/h8-11,18,22H,4-7,12-14H2,1-3H3,(H,20,23)/t18-/m1/s1