Vitas-M small molecule compound
methyl 3-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)thiophene-2-carboxylate
Catalog ID
STL167948
SMILES COC(=O)c1sccc1NC(=O)CN1CCN(CC1)C(c1ccccc1)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 C25H27N3O3S MW 449.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O3S/c1-31-25(30)24-21(12-17-32-24)26-22(29)18-27-13-15-28(16-14-27)23(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-12,17,23H,13-16,18H2,1H3,(H,26,29)InChIKey
QBASADZQEQZXJM-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C=CS1)NC(=O)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4
InChI=1SC25H27N3O3Sc13125(30)2421(12173224)2622(29)1827131528(161427)23(198425919)20106371120h2121723H131618H21H3(H2629)
methyl3(((4(diphenylmethyl)piperazin1yl)acetyl)amino)thiophene2carboxylate
methyl3((2(4benzhydrylpiperazin1yl)acetyl)amino)thiophene2carboxylate
MFCD20754771
ZINC000071775382
ZINC71775382
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