64S
Summary
| Name: | N-ethyl-6,7-dimethoxyquinazolin-4-amine |
| Formula: | C12 H15 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 233.266 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-ethyl-6,7-dimethoxyquinazolin-4-amine |
| OpenEye OEToolkits | 2.0.4 | ~{N}-ethyl-6,7-dimethoxy-quinazolin-4-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c2(cc1c(c(NCC)ncn1)cc2OC)OC |
| InChI | InChI | 1.03 | InChI=1S/C12H15N3O2/c1-4-13-12-8-5-10(16-2)11(17-3)6-9(8)14-7-15-12/h5-7H,4H2,1-3H3,(H,13,14,15) |
| InChIKey | InChI | 1.03 | XPYCWBYQQPWQJO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCNc1ncnc2cc(OC)c(OC)cc12 |
| SMILES | CACTVS | 3.385 | CCNc1ncnc2cc(OC)c(OC)cc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | CCNc1c2cc(c(cc2ncn1)OC)OC |
| SMILES | OpenEye OEToolkits | 2.0.4 | CCNc1c2cc(c(cc2ncn1)OC)OC |
