Y5M
Summary
| Name: | 7-methoxy-4-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-3,4-dihydroquinoxalin-2(1H)-one |
| Formula: | C17 H18 N4 O2 |
| Formal charge: | 0 |
| Formula weight: | 310.35 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 7-methoxy-4-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-3,4-dihydroquinoxalin-2(1H)-one |
| OpenEye OEToolkits | 2.0.7 | 7-methoxy-4-(2-methyl-6,7-dihydro-5~{H}-cyclopenta[d]pyrimidin-4-yl)-1,3-dihydroquinoxalin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cc1nc4c(c(n1)N3c2ccc(cc2NC(C3)=O)OC)CCC4 |
| InChI | InChI | 1.03 | InChI=1S/C17H18N4O2/c1-10-18-13-5-3-4-12(13)17(19-10)21-9-16(22)20-14-8-11(23-2)6-7-15(14)21/h6-8H,3-5,9H2,1-2H3,(H,20,22) |
| InChIKey | InChI | 1.03 | UEPKZTFWZFQXML-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc2N(CC(=O)Nc2c1)c3nc(C)nc4CCCc34 |
| SMILES | CACTVS | 3.385 | COc1ccc2N(CC(=O)Nc2c1)c3nc(C)nc4CCCc34 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1nc2c(c(n1)N3CC(=O)Nc4c3ccc(c4)OC)CCC2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1nc2c(c(n1)N3CC(=O)Nc4c3ccc(c4)OC)CCC2 |
