Vitas-M small molecule compound
4-{6-[2-(4-chlorophenoxy)propan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}-N,N-dimethylaniline
Catalog ID
STK242225
SMILES Clc1ccc(cc1)OC(c1nn2c(s1)nnc2c1ccc(cc1)N(C)C)(C)C
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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 C20H20ClN5OS MW 413.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN5OS/c1-20(2,27-16-11-7-14(21)8-12-16)18-24-26-17(22-23-19(26)28-18)13-5-9-15(10-6-13)25(3)4/h5-12H,1-4H3InChIKey
KNKFUPASQCREAZ-UHFFFAOYSA-NSynonyms
4(6(2(4CHLOROPHENOXY)PROPAN2YL)(124)TRIAZOLO(34B)(134)THIADIAZOL3YL)NNDIMETHYLANILINE
CC(C)(C1=NN2C(=NN=C2S1)C3=CC=C(C=C3)N(C)C)OC4=CC=C(C=C4)Cl
InChI=1SC20H20ClN5OSc120(2271611714(21)81216)18242617(222319(26)2818)135915(10613)25(3)4h512H14H3
MFCD08671546
ZINC000013842969
ZINC13842969
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