FNM
Summary
Name: | (5S)-5-methyl-2-(methylsulfanyl)-5-phenyl-3-(phenylamino)-3,5-dihydro-4H-imidazol-4-one |
Formula: | C17 H17 N3 O S |
Formal charge: | 0 |
Formula weight: | 311.401 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 1.6.1 | (5S)-5-methyl-2-methylsulfanyl-5-phenyl-3-phenylazanyl-imidazol-4-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES_CANONICAL | CACTVS | 3.352 | CSC1=N[C@](C)(C(=O)N1Nc2ccccc2)c3ccccc3 |
SMILES | CACTVS | 3.352 | CSC1=N[C](C)(C(=O)N1Nc2ccccc2)c3ccccc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C[C@@]1(C(=O)N(C(=N1)SC)Nc2ccccc2)c3ccccc3 |
SMILES | OpenEye OEToolkits | 1.7.0 | CC1(C(=O)N(C(=N1)SC)Nc2ccccc2)c3ccccc3 |
InChI | InChI | 1.03 | InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1 |
InChIKey | InChI | 1.03 | LMVPQMGRYSRMIW-KRWDZBQOSA-N |