Vitas-M small molecule compound
ethyl {[5-(propan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Catalog ID
STK475878
SMILES C=CCn1c(SCC(=O)OCC)nnc1C(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 C12H19N3O2S MW 269.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H19N3O2S/c1-5-7-15-11(9(3)4)13-14-12(15)18-8-10(16)17-6-2/h5,9H,1,6-8H2,2-4H3InChIKey
QUUYWUGCXMQFOT-UHFFFAOYSA-NSynonyms
CCOC(=O)CSC1=NN=C(N1CC=C)C(C)C
ethyl((5(propan2yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetate
ETHYL2((5PROPAN2YL4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETATE
ETHYL2(5(METHYLETHYL)4PROP2ENYL124TRIAZOL3YLTHIO)ACETATE
InChI=1SC12H19N3O2Sc1571511(9(3)4)131412(15)18810(16)1762h59H168H224H3
MFCD06112229
ZINC000006729016
ZINC06729016
ZINC6729016
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