NTU
Summary
Name: | N1,N14-BIS((S-METHYL)ISOTHIOUREIDO)TETRADECANE |
Formula: | C18 H38 N4 S2 |
Formal charge: | 0 |
Formula weight: | 374.651 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | dimethyl N',N'''-tetradecane-1,14-diylbis(imidothiocarbamate) |
OpenEye OEToolkits | 1.5.0 | N'-[14-[(amino-methylsulfanyl-methylidene)amino]tetradecyl]-1-methylsulfanyl-methanimidamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | N(=C(/SC)N)\CCCCCCCCCCCCCC/N=C(\SC)N |
SMILES_CANONICAL | CACTVS | 3.341 | CSC(N)=NCCCCCCCCCCCCCCN=C(N)SC |
SMILES | CACTVS | 3.341 | CSC(N)=NCCCCCCCCCCCCCCN=C(N)SC |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CS/C(=N\CCCCCCCCCCCCCCN=C(N)SC)/N |
SMILES | OpenEye OEToolkits | 1.5.0 | CSC(=NCCCCCCCCCCCCCCN=C(N)SC)N |
InChI | InChI | 1.03 | InChI=1S/C18H38N4S2/c1-23-17(19)21-15-13-11-9-7-5-3-4-6-8-10-12-14-16-22-18(20)24-2/h3-16H2,1-2H3,(H2,19,21)(H2,20,22) |
InChIKey | InChI | 1.03 | IOKDMHHZKWLWKO-UHFFFAOYSA-N |