(2R)-2-[(4-acetamidophenyl)methylamino]-N-hexadecyl-3-methylsulfanyl-propanamide

Systemtic Name: (2R)-2-[(4-acetamidophenyl)methylamino]-N-hexadecyl-3-methylsulfanyl-propanamide Openeye Name: (2R)-2-[(4-acetamidophenyl)methylamino]-N-hexadecyl-3-methylsulfanyl-propanamide CAS Name: (2R)-2-[(4-acetamidophenyl)methylamino]-N-hexadecyl-3-(methylthio)propanamide IUPAC Name: (2R)-2-[(4-acetamidophenyl)methylamino]-N-hexadecyl-3-methylsulfanylpropanamide Traditional Name: (2R)-2-[(4-acetamidobenzyl)amino]-N-cetyl-3-(methylthio)propionamide Formula: C29H51N3O2S MolecularWeight: 505.79914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)C(CSC)NCC1=CC=C(C=C1)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=O)[C@H](CSC)NCC1=CC=C(C=C1)NC(=O)C

InChI

InChI=1S/C29H51N3O2S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-30-29(34)28(24-35-3)31-23-26-18-20-27(21-19-26)32-25(2)33/h18-21,28,31H,4-17,22-24H2,1-3H3,(H,30,34)(H,32,33)/t28-/m0/s1