Vitas-M small molecule compound
N-(2,5-dimethoxybenzyl)-3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazole-4-carboxamide
Catalog ID
STL133117
SMILES COc1ccc(c(c1)CNC(=O)c1cn(nc1S(=O)(=O)N1CCN(CC1)c1cccc(c1C)C)CC)OC
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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 C27H35N5O5S MW 541.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35N5O5S/c1-6-31-18-23(26(33)28-17-21-16-22(36-4)10-11-25(21)37-5)27(29-31)38(34,35)32-14-12-30(13-15-32)24-9-7-8-19(2)20(24)3/h7-11,16,18H,6,12-15,17H2,1-5H3,(H,28,33)InChIKey
CUMXLIFCJMNVFW-UHFFFAOYSA-NSynonyms
CCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)C(=O)NCC4=C(C=CC(=C4)OC)OC
InChI=1SC27H35N5O5Sc16311823(26(33)2817211622(364)101125(21)375)27(2931)38(3435)32141230(131532)2497819(2)20(24)3h7111618H6121517H215H3(H2833)
MFCD20753060
N((25dimethoxyphenyl)methyl)3(4(23dimethylphenyl)piperazin1yl)sulfonyl1ethylpyrazole4carboxamide
N(25dimethoxybenzyl)3((4(23dimethylphenyl)piperazin1yl)sulfonyl)1ethyl1Hpyrazole4carboxamide
ZINC000102920897
ZINC102920897
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