Vitas-M small molecule compound
3-phenylpropyl 4-(2-bromophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Catalog ID
STK064567
SMILES O=C1NC(=C(C(C1)c1ccccc1Br)C(=O)OCCCc1ccccc1)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 C22H22BrNO3 MW 428.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22BrNO3/c1-15-21(22(26)27-13-7-10-16-8-3-2-4-9-16)18(14-20(25)24-15)17-11-5-6-12-19(17)23/h2-6,8-9,11-12,18H,7,10,13-14H2,1H3,(H,24,25)InChIKey
HUNMRBBJTRHNPF-UHFFFAOYSA-NSynonyms
3phenylpropyl4(2bromophenyl)2methyl6oxo1456tetrahydropyridine3carboxylate
3PHENYLPROPYL4(2BROMOPHENYL)2METHYL6OXO145TRIHYDROPYRIDINE3CARBOXYLATE
3PHENYLPROPYL4(2BROMOPHENYL)6METHYL2OXO34DIHYDRO1HPYRIDINE5CARBOXYLATE
CC1=C(C(CC(=O)N1)C2=CC=CC=C2Br)C(=O)OCCCC3=CC=CC=C3
InChI=1SC22H22BrNO3c11521(22(26)2713710168324916)18(1420(25)2415)1711561219(17)23h2689111218H7101314H21H3(H2425)
MFCD02038562
O=C1NC(=C(C(C1)c1ccccc1Br)C(=O)OCCCc1ccccc1)C
STK064567
ZINC000008893206
ZINC000012416455
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