Vitas-M small molecule compound
propan-2-yl 2-[({[5-(1,3-dimethyl-1H-pyrazol-5-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK302843
SMILES CCn1c(SCC(=O)Nc2sc3c(c2C(=O)OC(C)C)CCCC3)nnc1c1cc(nn1C)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 C23H30N6O3S2 MW 502.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N6O3S2/c1-6-29-20(16-11-14(4)27-28(16)5)25-26-23(29)33-12-18(30)24-21-19(22(31)32-13(2)3)15-9-7-8-10-17(15)34-21/h11,13H,6-10,12H2,1-5H3,(H,24,30)InChIKey
FRMRCXQGOWMKHB-UHFFFAOYSA-NSynonyms
1005642-99-81005642998
CCN1C(=NN=C1SCC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC(C)C)C4=CC(=NN4C)C
InChI=1SC23H30N6O3S2c162920(161114(4)2728(16)5)252623(29)331218(30)242119(22(31)3213(2)3)159781017(15)3421h1113H61012H215H3(H2430)
MFCD04048707
propan2yl2((((5(13dimethyl1Hpyrazol5yl)4ethyl4H124triazol3yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
propan2yl2((2((5(25dimethylpyrazol3yl)4ethyl124triazol3yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000002743787
ZINC02743787
ZINC2743787
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