Vitas-M small molecule compound
N-(3-chloro-2-methylphenyl)-6-(4-methoxyphenyl)-3-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359181
SMILES COc1ccc(cc1)C1Nn2c(SC1C(=O)Nc1cccc(c1C)Cl)nnc2c1ccccc1
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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 C25H22ClN5O2S MW 492.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O2S/c1-15-19(26)9-6-10-20(15)27-24(32)22-21(16-11-13-18(33-2)14-12-16)30-31-23(28-29-25(31)34-22)17-7-4-3-5-8-17/h3-14,21-22,30H,1-2H3,(H,27,32)InChIKey
POHCRIZQFUUEKP-UHFFFAOYSA-NSynonyms
CC1=C(C=CC=C1Cl)NC(=O)C2C(NN3C(=NN=C3S2)C4=CC=CC=C4)C5=CC=C(C=C5)OC
InChI=1SC25H22ClN5O2Sc11519(26)961020(15)2724(32)2221(16111318(332)141216)303123(282925(31)3422)177435817h314212230H12H3(H2732)
MFCD08098588
N(3chloro2methylphenyl)6(4methoxyphenyl)3phenyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009238050
ZINC000009238054
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