| PDB CCD ID: | WCM |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C19 H22 N2 O3 |
| InChI: | InChI=1S/C19H22N2O3/c1-13(19(23)24)21(2)18(22)17(20)12-14-8-10-16(11-9-14)15-6-4-3-5-7-15/h3-11,13,17H,12,20H2,1-2H3,(H,23,24)/t13-,17-/m0/s1 |
| InChIKey: | VNVOGAHOYJRAAI-GUYCJALGSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | C[CH](N(C)C(=O)[CH](N)Cc1ccc(cc1)c2ccccc2)C(O)=O | | CACTVS 3.385 | C[C@H](N(C)C(=O)[C@@H](N)Cc1ccc(cc1)c2ccccc2)C(O)=O | | OpenEye OEToolkits 2.0.7 | CC(C(=O)O)N(C)C(=O)C(Cc1ccc(cc1)c2ccccc2)N | | OpenEye OEToolkits 2.0.7 | C[C@@H](C(=O)O)N(C)C(=O)[C@H](Cc1ccc(cc1)c2ccccc2)N | | ACDLabs 12.01 | C(C(Cc2ccc(c1ccccc1)cc2)N)(N(C(C)C(O)=O)C)=O |
|
| Name: | (2S)-2-amino-3-(biphenyl-4-yl)-N-methyl-N-[(2S)-1-oxopropan-2-yl]propanamide (non-preferred name) |
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