SEQ
Summary
Name: | ~{N}-cyclohexyl-2-cyclopropyl-quinazolin-4-amine |
Synonyms: | TH10785 |
Formula: | C17 H21 N3 |
Formal charge: | 0 |
Formula weight: | 267.369 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ~{N}-cyclohexyl-2-cyclopropyl-quinazolin-4-amine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C17H21N3/c1-2-6-13(7-3-1)18-17-14-8-4-5-9-15(14)19-16(20-17)12-10-11-12/h4-5,8-9,12-13H,1-3,6-7,10-11H2,(H,18,19,20) |
InChIKey | InChI | 1.03 | ZQMGQZOHIDOPCQ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C1CCC(CC1)Nc2nc(nc3ccccc23)C4CC4 |
SMILES | CACTVS | 3.385 | C1CCC(CC1)Nc2nc(nc3ccccc23)C4CC4 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(nc(n2)C3CC3)NC4CCCCC4 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c(nc(n2)C3CC3)NC4CCCCC4 |