Vitas-M small molecule compound
ethyl (2E)-2-{[(2Z)-3-(4-chlorophenyl)-2-cyanoprop-2-enoyl]imino}-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STK590337
SMILES CCOC(=O)c1s/c(=N/C(=O)/C(=C\c2ccc(cc2)Cl)/C#N)/[nH]c1C
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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 C17H14ClN3O3S MW 375.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClN3O3S/c1-3-24-16(23)14-10(2)20-17(25-14)21-15(22)12(9-19)8-11-4-6-13(18)7-5-11/h4-8H,3H2,1-2H3,(H,20,21,22)/b12-8-InChIKey
KLBAFVARMBROHD-WQLSENKSSA-NSynonyms
469869-75-8469869758
CCOC(=O)C1=C(N=C(S1)NC(=O)C(=CC2=CC=C(C=C2)Cl)C#N)C
CCOC(=O)c1sc(=NC(=O)C(=Cc2ccc(cc2)Cl)C#N)(nH)c1C
ethyl(2E)2(((2Z)3(4chlorophenyl)2cyanoprop2enoyl)imino)4methyl23dihydro13thiazole5carboxylate
ETHYL2(((Z)3(4CHLOROPHENYL)2CYANOPROP2ENOYL)AMINO)4METHYL13THIAZOLE5CARBOXYLATE
ETHYL2((2Z)3(4CHLOROPHENYL)2CYANOPROP2ENOYLAMINO)4METHYL13THIAZOLE5CARBOXYLATE
InChI=1SC17H14ClN3O3Sc132416(23)1410(2)2017(2514)2115(22)12(919)8114613(18)7511h48H3H212H3(H202122)b128
MFCD07201231
ZINC000009348883
ZINC09348883
ZINC9348883
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