1PK
Summary
Name: | 1H-perimidin-2-amine |
Formula: | C11 H9 N3 |
Formal charge: | 0 |
Formula weight: | 183.209 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 1H-perimidin-2-amine |
OpenEye OEToolkits | 1.7.6 | 1H-perimidin-2-amine |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | N=3c2cccc1cccc(c12)NC=3N |
InChI | InChI | 1.03 | InChI=1S/C11H9N3/c12-11-13-8-5-1-3-7-4-2-6-9(14-11)10(7)8/h1-6H,(H3,12,13,14) |
InChIKey | InChI | 1.03 | UNDUSVBXIVZGOQ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | NC1=Nc2cccc3cccc(N1)c23 |
SMILES | CACTVS | 3.370 | NC1=Nc2cccc3cccc(N1)c23 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc2cccc3c2c(c1)NC(=N3)N |
SMILES | OpenEye OEToolkits | 1.7.6 | c1cc2cccc3c2c(c1)NC(=N3)N |