Vitas-M small molecule compound
N-(3-chloro-4-methylphenyl)-6-(4-fluorophenyl)-3-methyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL358865
SMILES Fc1ccc(cc1)C1Nn2c(SC1C(=O)Nc1ccc(c(c1)Cl)C)nnc2C
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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 C19H17ClFN5OS MW 417.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClFN5OS/c1-10-3-8-14(9-15(10)20)22-18(27)17-16(12-4-6-13(21)7-5-12)25-26-11(2)23-24-19(26)28-17/h3-9,16-17,25H,1-2H3,(H,22,27)InChIKey
BABSJBHHXREDTD-UHFFFAOYSA-NSynonyms
892238-06-1892238061
CC1=C(C=C(C=C1)NC(=O)C2C(NN3C(=NN=C3S2)C)C4=CC=C(C=C4)F)Cl
InChI=1SC19H17ClFN5OSc1103814(915(10)20)2218(27)1716(124613(21)7512)252611(2)232419(26)2817h39161725H12H3(H2227)
MFCD08098538
N(3chloro4methylphenyl)6(4fluorophenyl)3methyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009237588
ZINC000009237593
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