8OH
Summary
| Name: | 2-phenyl-~{N}4-(thiophen-2-ylmethyl)quinazoline-4,7-diamine |
| Formula: | C19 H16 N4 S |
| Formal charge: | 0 |
| Formula weight: | 332.422 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 2-phenyl-~{N}4-(thiophen-2-ylmethyl)quinazoline-4,7-diamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C19H16N4S/c20-14-8-9-16-17(11-14)22-18(13-5-2-1-3-6-13)23-19(16)21-12-15-7-4-10-24-15/h1-11H,12,20H2,(H,21,22,23) |
| InChIKey | InChI | 1.03 | XJFBKOHIJPRDGC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1ccc2c(NCc3sccc3)nc(nc2c1)c4ccccc4 |
| SMILES | CACTVS | 3.385 | Nc1ccc2c(NCc3sccc3)nc(nc2c1)c4ccccc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)c2nc3cc(ccc3c(n2)NCc4cccs4)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)c2nc3cc(ccc3c(n2)NCc4cccs4)N |
