Vitas-M small molecule compound
6-(3-chloro-4-methoxyphenyl)-N-(4-fluorophenyl)-3-propyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL360080
SMILES CCCc1nnc2n1NC(c1ccc(c(c1)Cl)OC)C(S2)C(=O)Nc1ccc(cc1)F
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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 C21H21ClFN5O2S MW 461.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClFN5O2S/c1-3-4-17-25-26-21-28(17)27-18(12-5-10-16(30-2)15(22)11-12)19(31-21)20(29)24-14-8-6-13(23)7-9-14/h5-11,18-19,27H,3-4H2,1-2H3,(H,24,29)InChIKey
QCKHXYCUWSDMPE-UHFFFAOYSA-NSynonyms
874587-65-26(3chloro4methoxyphenyl)N(4fluorophenyl)3propyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
874587652
CCCC1=NN=C2N1NC(C(S2)C(=O)NC3=CC=C(C=C3)F)C4=CC(=C(C=C4)OC)Cl
InChI=1SC21H21ClFN5O2Sc1341725262128(17)2718(1251016(302)15(22)1112)19(3121)20(29)24148613(23)7914h511181927H34H212H3(H2429)
MFCD07433562
ZINC000009295012
ZINC000009295015
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