GA0
Summary
Name: | GLYCYLALANYL-N-2-NAPHTHYL-L-PROLINEAMIDE |
Synonyms: | GLYCYL-ALANYL-PROLINE-BETA-NAPHTHYLAMIDE |
Formula: | C20 H24 N4 O3 |
Formal charge: | 0 |
Formula weight: | 368.43 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | glycyl-L-alanyl-N-naphthalen-2-yl-L-prolinamide |
OpenEye OEToolkits | 1.5.0 | (2S)-1-[(2S)-2-(2-aminoethanoylamino)propanoyl]-N-naphthalen-2-yl-pyrrolidine-2-carboxamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(Nc2cc1ccccc1cc2)C3N(C(=O)C(NC(=O)CN)C)CCC3 |
SMILES_CANONICAL | CACTVS | 3.341 | C[C@H](NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)Nc2ccc3ccccc3c2 |
SMILES | CACTVS | 3.341 | C[CH](NC(=O)CN)C(=O)N1CCC[CH]1C(=O)Nc2ccc3ccccc3c2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@@H](C(=O)N1CCC[C@H]1C(=O)Nc2ccc3ccccc3c2)NC(=O)CN |
SMILES | OpenEye OEToolkits | 1.5.0 | CC(C(=O)N1CCCC1C(=O)Nc2ccc3ccccc3c2)NC(=O)CN |
InChI | InChI | 1.03 | InChI=1S/C20H24N4O3/c1-13(22-18(25)12-21)20(27)24-10-4-7-17(24)19(26)23-16-9-8-14-5-2-3-6-15(14)11-16/h2-3,5-6,8-9,11,13,17H,4,7,10,12,21H2,1H3,(H,22,25)(H,23,26)/t13-,17-/m0/s1 |
InChIKey | InChI | 1.03 | KCELZXZDIUJGNM-GUYCJALGSA-N |