N-[2-(2-azanylethylcarbamoylamino)sulfanylethyl]-N',N'-di(tetradecyl)butanediamide

Systemtic Name: N-[2-(2-azanylethylcarbamoylamino)sulfanylethyl]-N',N'-di(tetradecyl)butanediamide Openeye Name: N-[2-(2-aminoethylcarbamoylamino)sulfanylethyl]-N',N'-di(tetradecyl)butanediamide CAS Name: N-[2-[[[(2-aminoethylamino)-oxomethyl]amino]thio]ethyl]-N',N'-di(tetradecyl)butanediamide IUPAC Name: N-[2-(2-aminoethylcarbamoylamino)sulfanylethyl]-N',N'-di(tetradecyl)butanediamide Traditional Name: N-[2-[(2-aminoethylcarbamoylamino)thio]ethyl]-N',N'-dimyristyl-succinamide Formula: C37H75N5O3S MolecularWeight: 670.0881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCN(CCCCCCCCCCCCCC)C(=O)CCC(=O)NCCSNC(=O)NCCN

Isomeric SMILES

CCCCCCCCCCCCCCN(CCCCCCCCCCCCCC)C(=O)CCC(=O)NCCSNC(=O)NCCN

InChI

InChI=1S/C37H75N5O3S/c1-3-5-7-9-11-13-15-17-19-21-23-25-32-42(33-26-24-22-20-18-16-14-12-10-8-6-4-2)36(44)28-27-35(43)39-31-34-46-41-37(45)40-30-29-38/h3-34,38H2,1-2H3,(H,39,43)(H2,40,41,45)