Vitas-M small molecule compound
N-(5-chloro-2,1,3-benzothiadiazol-4-yl)-4-(4-methylpiperidin-1-yl)-3-nitrobenzenecarbothioamide
Catalog ID
STL089369
SMILES CC1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(=S)Nc1c(Cl)ccc2c1nsn2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H18ClN5O2S2 MW 447.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN5O2S2/c1-11-6-8-24(9-7-11)15-5-2-12(10-16(15)25(26)27)19(28)21-17-13(20)3-4-14-18(17)23-29-22-14/h2-5,10-11H,6-9H2,1H3,(H,21,28)InChIKey
VIGPOJFXBQJGCE-UHFFFAOYSA-NSynonyms
CC1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(=S)Nc1c(Cl)ccc2c1nsn2
CC1CCN(CC1)C2=C(C=C(C=C2)C(=S)NC3=C(C=CC4=NSN=C43)Cl)(N+)(=O)(O)
InChI=1SC19H18ClN5O2S2c1116824(9711)155212(1016(15)25(26)27)19(28)211713(20)341418(17)23292214h251011H69H21H3(H2128)
MFCD13969122
N(5chloro213benzothiadiazol4yl)4(4methylpiperidin1yl)3nitrobenzenecarbothioamide
ZINC000030822883
ZINC30822883
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