(2S)-N-butyl-N-methyl-2-[(phenylmethylsulfanyl)amino]butanediamide

Systemtic Name: (2S)-N-butyl-N-methyl-2-[(phenylmethylsulfanyl)amino]butanediamide Openeye Name: (2S)-2-(benzylsulfanylamino)-N-butyl-N-methyl-butanediamide CAS Name: (2S)-N-butyl-N-methyl-2-[(phenylmethylthio)amino]butanediamide IUPAC Name: (2S)-2-(benzylsulfanylamino)-N-butyl-N-methylbutanediamide Traditional Name: (2S)-2-[(benzylthio)amino]-N-butyl-N-methyl-succinamide Formula: C16H25N3O2S MolecularWeight: 323.4536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C(CC(=O)N)NSCC1=CC=CC=C1

Isomeric SMILES

CCCCN(C)C(=O)[C@H](CC(=O)N)NSCC1=CC=CC=C1

InChI

InChI=1S/C16H25N3O2S/c1-3-4-10-19(2)16(21)14(11-15(17)20)18-22-12-13-8-6-5-7-9-13/h5-9,14,18H,3-4,10-12H2,1-2H3,(H2,17,20)/t14-/m0/s1