Vitas-M small molecule compound
2-{[5-(2-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide
Catalog ID
STK219145
SMILES C=CCn1c(SCC(=O)Nc2nc3c(s2)cc(cc3)OC)nnc1c1ccccc1F
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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 C21H18FN5O2S2 MW 455.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN5O2S2/c1-3-10-27-19(14-6-4-5-7-15(14)22)25-26-21(27)30-12-18(28)24-20-23-16-9-8-13(29-2)11-17(16)31-20/h3-9,11H,1,10,12H2,2H3,(H,23,24,28)InChIKey
RCGZHTYPYVGVJX-UHFFFAOYSA-NSynonyms
2((5(2FLUOROPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)N(6METHOXY13BENZOTHIAZOL2YL)ACETAMIDE
2((5(2FLUOROPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(6METHOXY13BENZOTHIAZOL2YL)ACETAMIDE
COC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NN=C(N3CC=C)C4=CC=CC=C4F
InChI=1SC21H18FN5O2S2c13102719(14645715(14)22)252621(27)301218(28)242023169813(292)1117(16)3120h3911H11012H22H3(H232428)
MFCD07399540
ZINC000009302477
ZINC09302477
ZINC9302477
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