CLZ
Summary
Name: | 5-CHLORYL-2,4,6-QUINAZOLINETRIAMINE |
Formula: | C8 H8 Cl N5 |
Formal charge: | 0 |
Formula weight: | 209.636 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 5-chloroquinazoline-2,4,6-triamine |
OpenEye OEToolkits | 2.0.7 | 5-chloranylquinazoline-2,4,6-triamine |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Nc1nc(N)nc2ccc(N)c(Cl)c21 |
InChI | InChI | 1.06 | InChI=1S/C8H8ClN5/c9-6-3(10)1-2-4-5(6)7(11)14-8(12)13-4/h1-2H,10H2,(H4,11,12,13,14) |
InChIKey | InChI | 1.06 | JZWXVYNQIJJTKF-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1nc(N)c2c(Cl)c(N)ccc2n1 |
SMILES | CACTVS | 3.385 | Nc1nc(N)c2c(Cl)c(N)ccc2n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c(c(c1N)Cl)c(nc(n2)N)N |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c(c(c1N)Cl)c(nc(n2)N)N |