Vitas-M small molecule compound
ethyl 1-{(Z)-[2,4,6-trioxo-1-(thiophen-2-ylmethyl)tetrahydropyrimidin-5(2H)-ylidene]methyl}piperidine-4-carboxylate
Catalog ID
STL372426
SMILES CCOC(=O)C1CCN(CC1)/C=C\1/C(=O)NC(=O)N(C1=O)Cc1cccs1
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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 C18H21N3O5S MW 391.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O5S/c1-2-26-17(24)12-5-7-20(8-6-12)11-14-15(22)19-18(25)21(16(14)23)10-13-4-3-9-27-13/h3-4,9,11-12H,2,5-8,10H2,1H3,(H,19,22,25)/b14-11-InChIKey
HLVKPEMIGFUYLC-KAMYIIQDSA-NSynonyms
CCOC(=O)C1CCN(CC1)C=C1C(=O)NC(=O)N(C1=O)Cc1cccs1
CCOC(=O)C1CCN(CC1)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=CS3
ETHYL1((Z)(246TRIOXO1(THIOPHEN2YLMETHYL)13DIAZINAN5YLIDENE)METHYL)PIPERIDINE4CARBOXYLATE
ethyl1((Z)(246trioxo1(thiophen2ylmethyl)tetrahydropyrimidin5(2H)ylidene)methyl)piperidine4carboxylate
InChI=1SC18H21N3O5Sc122617(24)125720(8612)111415(22)1918(25)21(16(14)23)10134392713h3491112H25810H21H3(H192225)b1411
MFCD03711936
ZINC000022358276
ZINC22358276
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