Vitas-M small molecule compound
N-(4-ethoxybenzyl)-1-(4-oxo-7-phenyl-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)piperidine-3-carboxamide
Catalog ID
STL097480
SMILES CCOc1ccc(cc1)CNC(=O)C1CCCN(C1)c1nc2c(csc2c(=O)[nH]1)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 C27H28N4O3S MW 488.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3S/c1-2-34-21-12-10-18(11-13-21)15-28-25(32)20-9-6-14-31(16-20)27-29-23-22(19-7-4-3-5-8-19)17-35-24(23)26(33)30-27/h3-5,7-8,10-13,17,20H,2,6,9,14-16H2,1H3,(H,28,32)(H,29,30,33)InChIKey
SJPBMODSYWYEMQ-UHFFFAOYSA-NSynonyms
1242906-55-31242906553
CCOC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C3=NC(=O)C4=C(N3)C(=CS4)C5=CC=CC=C5
CCOc1ccc(cc1)CNC(=O)C1CCCN(C1)c1nc2c(csc2c(=O)(nH)1)c1ccccc1
InChI=1SC27H28N4O3Sc123421121018(111321)152825(32)20961431(1620)27292322(197435819)173524(23)26(33)3027h357810131720H2691416H21H3(H2832)(H293033)
MFCD18789153
N((4ethoxyphenyl)methyl)1(4oxo7phenyl1Hthieno(32d)pyrimidin2yl)piperidine3carboxamide
N(4ethoxybenzyl)1(4oxo7phenyl34dihydrothieno(32d)pyrimidin2yl)piperidine3carboxamide
ZINC000049421154
ZINC000049421155
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