B2J
Summary
Name: | 4-(ethylsulfanyl)-6-methyl-1,3,5-triazin-2-amine |
Formula: | C6 H10 N4 S |
Formal charge: | 0 |
Formula weight: | 170.235 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 4-(ethylsulfanyl)-6-methyl-1,3,5-triazin-2-amine |
OpenEye OEToolkits | 1.7.2 | 4-ethylsulfanyl-6-methyl-1,3,5-triazin-2-amine |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | S(c1nc(nc(n1)N)C)CC |
InChI | InChI | 1.03 | InChI=1S/C6H10N4S/c1-3-11-6-9-4(2)8-5(7)10-6/h3H2,1-2H3,(H2,7,8,9,10) |
InChIKey | InChI | 1.03 | PJQMCVIFTDRXNT-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | CCSc1nc(C)nc(N)n1 |
SMILES | CACTVS | 3.370 | CCSc1nc(C)nc(N)n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CCSc1nc(nc(n1)N)C |
SMILES | OpenEye OEToolkits | 1.7.2 | CCSc1nc(nc(n1)N)C |