G0O
Summary
| Name: | (S)-N-(3-(2H-tetrazol-5-yl)phenyl)-3-mercapto-2-methylpropanamide |
| Formula: | C11 H13 N5 O S |
| Formal charge: | 0 |
| Formula weight: | 263.319 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-2-methyl-3-sulfanyl-~{N}-[3-(2~{H}-1,2,3,4-tetrazol-5-yl)phenyl]propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H13N5OS/c1-7(6-18)11(17)12-9-4-2-3-8(5-9)10-13-15-16-14-10/h2-5,7,18H,6H2,1H3,(H,12,17)(H,13,14,15,16)/t7-/m1/s1 |
| InChIKey | InChI | 1.03 | ZUTCRKIDPCRTLZ-SSDOTTSWSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H](CS)C(=O)Nc1cccc(c1)c2n[nH]nn2 |
| SMILES | CACTVS | 3.385 | C[CH](CS)C(=O)Nc1cccc(c1)c2n[nH]nn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@H](CS)C(=O)Nc1cccc(c1)c2n[nH]nn2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(CS)C(=O)Nc1cccc(c1)c2n[nH]nn2 |
