Vitas-M small molecule compound
(2Z)-5-(2-chlorophenyl)-2-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methylidene]-7-methyl-N-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Catalog ID
STL403682
SMILES CCn1nc(c(c1C)/C=C/1\SC2=NC(=C(C(N2C1)c1ccccc1Cl)C(=O)Nc1ccccc1)C)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 C28H28ClN5OS MW 518.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28ClN5OS/c1-5-34-19(4)23(17(2)32-34)15-21-16-33-26(22-13-9-10-14-24(22)29)25(18(3)30-28(33)36-21)27(35)31-20-11-7-6-8-12-20/h6-15,26H,5,16H2,1-4H3,(H,31,35)/b21-15-InChIKey
BYRUQYXDGPGSHW-QNGOZBTKSA-NSynonyms
1005669-69-1(2Z)5(2chlorophenyl)2((1ethyl35dimethyl1Hpyrazol4yl)methylidene)7methylNphenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxamide
(2Z)5(2CHLOROPHENYL)2((1ETHYL35DIMETHYLPYRAZOL4YL)METHYLIDENE)7METHYLNPHENYL35DIHYDRO(13)THIAZOLO(32A)PYRIMIDINE6CARBOXAMIDE
1005669691
CCN1C(=C(C(=N1)C)C=C2CN3C(C(=C(N=C3S2)C)C(=O)NC4=CC=CC=C4)C5=CC=CC=C5Cl)C
CCn1nc(c(c1C)C=C1SC2=NC(=C(C(N2C1)c1ccccc1Cl)C(=O)Nc1ccccc1)C)C
InChI=1SC28H28ClN5OSc153419(4)23(17(2)3234)1521163326(22139101424(22)29)25(18(3)3028(33)3621)27(35)3120117681220h61526H516H214H3(H3135)b2115
MFCD04049120
ZINC000022842967
ZINC000022842972
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