FD6
Summary
Name: | N-[2-(2-chloranylphenothiazin-10-yl)ethyl]-4-methyl-piperazin-1-amine |
Synonyms: | FD16 |
Formula: | C19 H23 Cl N4 S |
Formal charge: | 0 |
Formula weight: | 374.931 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 1.7.6 | N-[2-(2-chloranylphenothiazin-10-yl)ethyl]-4-methyl-piperazin-1-amine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C19H23ClN4S/c1-22-10-12-23(13-11-22)21-8-9-24-16-4-2-3-5-18(16)25-19-7-6-15(20)14-17(19)24/h2-7,14,21H,8-13H2,1H3 |
InChIKey | InChI | 1.03 | FCJWPLVHJGKUHJ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN1CCN(CC1)NCCN2c3ccccc3Sc4ccc(Cl)cc24 |
SMILES | CACTVS | 3.385 | CN1CCN(CC1)NCCN2c3ccccc3Sc4ccc(Cl)cc24 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CN1CCN(CC1)NCCN2c3ccccc3Sc4c2cc(cc4)Cl |
SMILES | OpenEye OEToolkits | 1.7.6 | CN1CCN(CC1)NCCN2c3ccccc3Sc4c2cc(cc4)Cl |