(2S)-2-acetamido-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: (2S)-2-acetamido-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: (2S)-2-acetamido-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: (2S)-2-acetamido-N-(2-dimethylaminoethyl)-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: (2S)-2-acetamido-N-(2-dimethylaminoethyl)-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: (2S)-2-acetamido-N-(2-dimethylaminoethyl)-3-[(4-methoxyphenyl)thio]propionamide Formula: C16H25N3O3S MolecularWeight: 339.453

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1=CC=C(C=C1)OC)C(=O)NCCN(C)C

Isomeric SMILES

CC(=O)N[C@H](CSC1=CC=C(C=C1)OC)C(=O)NCCN(C)C

InChI

InChI=1S/C16H25N3O3S/c1-12(20)18-15(16(21)17-9-10-19(2)3)11-23-14-7-5-13(22-4)6-8-14/h5-8,15H,9-11H2,1-4H3,(H,17,21)(H,18,20)/t15-/m1/s1