Vitas-M small molecule compound
(2E)-2-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-N,5-diphenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Catalog ID
STL397899
SMILES CCn1ncc(c1C)/C=c\1/sc2=NC(=C(C(n2c1=O)c1ccccc1)C(=O)Nc1ccccc1)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 C27H25N5O2S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O2S/c1-4-31-18(3)20(16-28-31)15-22-26(34)32-24(19-11-7-5-8-12-19)23(17(2)29-27(32)35-22)25(33)30-21-13-9-6-10-14-21/h5-16,24H,4H2,1-3H3,(H,30,33)/b22-15+InChIKey
XVHWKJMUWRYYON-PXLXIMEGSA-NSynonyms
494219-68-0(2E)2((1ETHYL5METHYL1HPYRAZOL4YL)METHYLIDENE)7METHYL3OXON5DIPHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
(2E)2((1ETHYL5METHYLPYRAZOL4YL)METHYLIDENE)7METHYL3OXON5DIPHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
494219680
CCN1C(=C(C=N1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)NC4=CC=CC=C4)C5=CC=CC=C5)C
CCn1ncc(c1C)C=c1sc2=NC(=C(C(n2c1=O)c1ccccc1)C(=O)Nc1ccccc1)C
InChI=1SC27H25N5O2Sc143118(3)20(162831)152226(34)3224(19117581219)23(17(2)2927(32)3522)25(33)30211396101421h51624H4H213H3(H3033)b2215+
MFCD02609150
ZINC000000650119
ZINC000002109052
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