(2S)-2-acetamido-3-(4-butylphenyl)sulfanyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide

Systemtic Name: (2S)-2-acetamido-3-(4-butylphenyl)sulfanyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide Openeye Name: (2S)-2-acetamido-3-(4-butylphenyl)sulfanyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]propanamide CAS Name: (2S)-2-acetamido-3-[(4-butylphenyl)thio]-N-[[(2R)-2-oxolanyl]methyl]propanamide IUPAC Name: (2S)-2-acetamido-3-(4-butylphenyl)sulfanyl-N-[[(2R)-oxolan-2-yl]methyl]propanamide Traditional Name: (2S)-2-acetamido-3-[(4-butylphenyl)thio]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]propionamide Formula: C20H30N2O3S MolecularWeight: 378.5288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)SCC(C(=O)NCC2CCCO2)NC(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)SC[C@H](C(=O)NC[C@H]2CCCO2)NC(=O)C

InChI

InChI=1S/C20H30N2O3S/c1-3-4-6-16-8-10-18(11-9-16)26-14-19(22-15(2)23)20(24)21-13-17-7-5-12-25-17/h8-11,17,19H,3-7,12-14H2,1-2H3,(H,21,24)(H,22,23)/t17-,19-/m1/s1