Vitas-M small molecule compound
N-{4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Catalog ID
STL160763
SMILES CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=S)N1CC2CC(C1)c1n(C2)c(=O)ccc1
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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 C22H24N6O3S3 MW 516.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N6O3S3/c1-2-19-24-25-21(33-19)26-34(30,31)17-8-6-16(7-9-17)23-22(32)27-11-14-10-15(13-27)18-4-3-5-20(29)28(18)12-14/h3-9,14-15H,2,10-13H2,1H3,(H,23,32)(H,25,26)InChIKey
GPHLENMXGCVMEY-UHFFFAOYSA-NSynonyms
(1R5R)N(4(N(5ethyl134thiadiazol2yl)sulfamoyl)phenyl)8oxo4568tetrahydro1H15methanopyrido(12a)(15)diazocine3(2H)carbothioamide
CCC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)N3CC4CC(C3)C5=CC=CC(=O)N5C4
CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=S)N1C(C@H)2CC(C1)c1n(C2)c(=O)ccc1
InChI=1SC22H24N6O3S3c1219242521(3319)2634(3031)178616(7917)2322(32)2711141015(1327)1843520(29)28(18)1214h391415H21013H21H3(H2332)(H2526)
MFCD09267023
N(4((5ethyl134thiadiazol2yl)sulfamoyl)phenyl)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carbothioamide
ZINC000015996675
Check stock
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