Vitas-M small molecule compound
(1S,5R)-N-{4-[(4,6-dimethylpyrimidin-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
STK784396
SMILES Cc1cc(C)nc(n1)NS(=O)(=O)c1ccc(cc1)NC(=S)N1C[C@H]2C[C@@H](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 C24H26N6O3S2 MW 510.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N6O3S2/c1-15-10-16(2)26-23(25-15)28-35(32,33)20-8-6-19(7-9-20)27-24(34)29-12-17-11-18(14-29)21-4-3-5-22(31)30(21)13-17/h3-10,17-18H,11-14H2,1-2H3,(H,27,34)(H,25,26,28)/t17-,18+/m0/s1InChIKey
CVCYYFHJWGQOQG-ZWKOTPCHSA-NSynonyms
(1R5R)N(4(N(46dimethylpyrimidin2yl)sulfamoyl)phenyl)8oxo4568tetrahydro1H15methanopyrido(12a)(15)diazocine3(2H)carbothioamide
(1S5R)N(4((46dimethylpyrimidin2yl)sulfamoyl)phenyl)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carbothioamide
Cc1cc(C)nc(n1)NS(=O)(=O)c1ccc(cc1)NC(=S)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
Cc1cc(C)nc(n1)NS(=O)(=O)c1ccc(cc1)NC(=S)N1C(C@H)2CC(C1)c1n(C2)c(=O)ccc1
MFCD13372244
ZINC000100212146
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