Vitas-M small molecule compound
propan-2-yl 2-[({[4-methyl-5-(2-methylfuran-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK473766
SMILES CC(OC(=O)c1c(NC(=O)CSc2nnc(n2C)c2ccoc2C)sc2c1CCCC2)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 C22H26N4O4S2 MW 474.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O4S2/c1-12(2)30-21(28)18-15-7-5-6-8-16(15)32-20(18)23-17(27)11-31-22-25-24-19(26(22)4)14-9-10-29-13(14)3/h9-10,12H,5-8,11H2,1-4H3,(H,23,27)InChIKey
OMRHBFJWVLPAEL-UHFFFAOYSA-NSynonyms
CC1=C(C=CO1)C2=NN=C(N2C)SCC(=O)NC3=C(C4=C(S3)CCCC4)C(=O)OC(C)C
InChI=1SC22H26N4O4S2c112(2)3021(28)1815756816(15)3220(18)2317(27)113122252419(26(22)4)149102913(14)3h91012H5811H214H3(H2327)
MFCD04868668
propan2yl2((((4methyl5(2methylfuran3yl)4H124triazol3yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
propan2yl2((2((4methyl5(2methylfuran3yl)124triazol3yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000020296015
ZINC20296015
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