(2S)-2-azanyl-5-[[azanyl-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]methylidene]amino]-N-(2,3-didodecoxypropyl)pentanamide

Systemtic Name: (2S)-2-azanyl-5-[[azanyl-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]methylidene]amino]-N-(2,3-didodecoxypropyl)pentanamide Openeye Name: (2S)-2-amino-5-[[amino-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]methylene]amino]-N-(2,3-didodecoxypropyl)pentanamide CAS Name: (2S)-2-amino-5-[[amino-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]methylidene]amino]-N-(2,3-didodecoxypropyl)pentanamide IUPAC Name: (2S)-2-amino-5-[[amino-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]methylidene]amino]-N-(2,3-didodecoxypropyl)pentanamide Traditional Name: (2S)-2-amino-5-[[amino-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonylamino]methylene]amino]-N-(2,3-dilauryloxypropyl)valeramide Formula: C43H81N5O6S MolecularWeight: 796.19814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCC(CNC(=O)C(CCCN=C(N)NS(=O)(=O)C1=C(C(=C(C=C1C)OC)C)C)N)OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOCC(CNC(=O)[C@H](CCCN=C(N)NS(=O)(=O)C1=C(C(=C(C=C1C)OC)C)C)N)OCCCCCCCCCCCC

InChI

InChI=1S/C43H81N5O6S/c1-7-9-11-13-15-17-19-21-23-25-30-53-34-38(54-31-26-24-22-20-18-16-14-12-10-8-2)33-47-42(49)39(44)28-27-29-46-43(45)48-55(50,51)41-35(3)32-40(52-6)36(4)37(41)5/h32,38-39H,7-31,33-34,44H2,1-6H3,(H,47,49)(H3,45,46,48)/t38?,39-/m0/s1