Vitas-M small molecule compound
methyl 5-ethyl-2-[({[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]thiophene-3-carboxylate
Catalog ID
STK467778
SMILES C=CCn1c(SCC(=O)Nc2sc(cc2C(=O)OC)CC)nnc1c1ccncc1
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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 C20H21N5O3S2 MW 443.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O3S2/c1-4-10-25-17(13-6-8-21-9-7-13)23-24-20(25)29-12-16(26)22-18-15(19(27)28-3)11-14(5-2)30-18/h4,6-9,11H,1,5,10,12H2,2-3H3,(H,22,26)InChIKey
UHYFVXFFORPUKG-UHFFFAOYSA-NSynonyms
CCC1=CC(=C(S1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=NC=C3)C(=O)OC
InChI=1SC20H21N5O3S2c14102517(1368219713)232420(25)291216(26)221815(19(27)283)1114(52)3018h46911H151012H223H3(H2226)
methyl5ethyl2((((4(prop2en1yl)5(pyridin4yl)4H124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
methyl5ethyl2((2((4prop2enyl5pyridin4yl124triazol3yl)sulfanyl)acetyl)amino)thiophene3carboxylate
METHYL5ETHYL2(2(4PROP2ENYL5(4PYRIDYL)(124TRIAZOL3YLTHIO))ACETYLAMINO)THIOPHENE3CARBOXYLATE
MFCD06191155
ZINC000019638670
ZINC19638670
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