RKH
Summary
Name: | 4-(2-methyl-1-benzofuran-5-yl)pyridine-2,6-diamine |
Formula: | C14 H13 N3 O |
Formal charge: | 0 |
Formula weight: | 239.273 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 4-(2-methyl-1-benzofuran-5-yl)pyridine-2,6-diamine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C14H13N3O/c1-8-4-11-5-9(2-3-12(11)18-8)10-6-13(15)17-14(16)7-10/h2-7H,1H3,(H4,15,16,17) |
InChIKey | InChI | 1.03 | BMBIGEJCNXQYPN-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1oc2ccc(cc2c1)c3cc(N)nc(N)c3 |
SMILES | CACTVS | 3.385 | Cc1oc2ccc(cc2c1)c3cc(N)nc(N)c3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc2cc(ccc2o1)c3cc(nc(c3)N)N |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc2cc(ccc2o1)c3cc(nc(c3)N)N |