Vitas-M small molecule compound
propan-2-yl 2-{[3-(1H-benzotriazol-1-yl)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK765336
SMILES CC(OC(=O)c1c(NC(=O)CCn2nnc3c2cccc3)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 C21H24N4O3S MW 412.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O3S/c1-13(2)28-21(27)19-14-7-3-6-10-17(14)29-20(19)22-18(26)11-12-25-16-9-5-4-8-15(16)23-24-25/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3,(H,22,26)InChIKey
KSYVSHKTGBOOGI-UHFFFAOYSA-NSynonyms
CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCN3C4=CC=CC=C4N=N3
InChI=1SC21H24N4O3Sc113(2)2821(27)19147361017(14)2920(19)2218(26)11122516954815(16)232425h458913H3671012H212H3(H2226)
MFCD02933650
propan2yl2((3(1Hbenzotriazol1yl)propanoyl)amino)4567tetrahydro1benzothiophene3carboxylate
propan2yl2(3(benzotriazol1yl)propanoylamino)4567tetrahydro1benzothiophene3carboxylate
ZINC000001068106
ZINC01068106
ZINC1068106
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