Vitas-M small molecule compound
ethyl 4-({3-[(4-cyclohexylphenoxy)methyl]-4-methyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl}methyl)piperazine-1-carboxylate
Catalog ID
STK733977
SMILES CCOC(=O)N1CCN(CC1)Cn1nc(n(c1=S)C)COc1ccc(cc1)C1CCCCC1
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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 C24H35N5O3S MW 473.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H35N5O3S/c1-3-31-24(30)28-15-13-27(14-16-28)18-29-23(33)26(2)22(25-29)17-32-21-11-9-20(10-12-21)19-7-5-4-6-8-19/h9-12,19H,3-8,13-18H2,1-2H3InChIKey
MUMAXPAMRAAINK-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCN(CC1)CN2C(=S)N(C(=N2)COC3=CC=C(C=C3)C4CCCCC4)C
ETHYL4((3((4CYCLOHEXYLPHENOXY)METHYL)4METHYL5SULFANYLIDENE124TRIAZOL1YL)METHYL)PIPERAZINE1CARBOXYLATE
ETHYL4((3((4CYCLOHEXYLPHENOXY)METHYL)4METHYL5THIOXO45DIHYDRO1H124TRIAZOL1YL)METHYL)1PIPERAZINECARBOXYLATE
ethyl4((3((4cyclohexylphenoxy)methyl)4methyl5thioxo45dihydro1H124triazol1yl)methyl)piperazine1carboxylate
InChI=1SC24H35N5O3Sc133124(30)28151327(141628)182923(33)26(2)22(2529)17322111920(101221)197546819h91219H381318H212H3
MFCD01305151
ZINC000019418827
ZINC19418827
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