(2S)-2-acetamido-N-butyl-3-(4-butylphenyl)sulfanyl-N-methyl-propanamide

Systemtic Name: (2S)-2-acetamido-N-butyl-3-(4-butylphenyl)sulfanyl-N-methyl-propanamide Openeye Name: (2S)-2-acetamido-N-butyl-3-(4-butylphenyl)sulfanyl-N-methyl-propanamide CAS Name: (2S)-2-acetamido-N-butyl-3-[(4-butylphenyl)thio]-N-methylpropanamide IUPAC Name: (2S)-2-acetamido-N-butyl-3-(4-butylphenyl)sulfanyl-N-methylpropanamide Traditional Name: (2S)-2-acetamido-N-butyl-3-[(4-butylphenyl)thio]-N-methyl-propionamide Formula: C20H32N2O2S MolecularWeight: 364.54528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H32N2O2S/c1-5-7-9-17-10-12-18(13-11-17)25-15-19(21-16(3)23)20(24)22(4)14-8-6-2/h10-13,19H,5-9,14-15H2,1-4H3,(H,21,23)/t19-/m1/s1