BP0
Summary
| Name: | 5,5'-(sulfanediyldiethane-2,1-diyl)bis(1,3,4-thiadiazol-2-amine) |
| Formula: | C8 H12 N6 S3 |
| Formal charge: | 0 |
| Formula weight: | 288.416 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5,5'-(sulfanediyldiethane-2,1-diyl)bis(1,3,4-thiadiazol-2-amine) |
| OpenEye OEToolkits | 1.7.6 | 5-[2-[2-(5-azanyl-1,3,4-thiadiazol-2-yl)ethylsulfanyl]ethyl]-1,3,4-thiadiazol-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | S(CCc1nnc(s1)N)CCc2nnc(s2)N |
| InChI | InChI | 1.03 | InChI=1S/C8H12N6S3/c9-7-13-11-5(16-7)1-3-15-4-2-6-12-14-8(10)17-6/h1-4H2,(H2,9,13)(H2,10,14) |
| InChIKey | InChI | 1.03 | AOAQKDDVWLOZFV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | Nc1sc(CCSCCc2sc(N)nn2)nn1 |
| SMILES | CACTVS | 3.370 | Nc1sc(CCSCCc2sc(N)nn2)nn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C(CSCCc1nnc(s1)N)c2nnc(s2)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | C(CSCCc1nnc(s1)N)c2nnc(s2)N |
