Vitas-M small molecule compound
N-(3,4-dimethoxybenzyl)-3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazole-4-carboxamide
Catalog ID
STL133118
SMILES COc1cc(CNC(=O)c2cn(nc2S(=O)(=O)N2CCN(CC2)c2cccc(c2C)C)CC)ccc1OC
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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/c1-6-31-18-22(26(33)28-17-21-10-11-24(36-4)25(16-21)37-5)27(29-31)38(34,35)32-14-12-30(13-15-32)23-9-7-8-19(2)20(23)3/h7-11,16,18H,6,12-15,17H2,1-5H3,(H,28,33)InChIKey
VUTYZZLENVFKKV-UHFFFAOYSA-NSynonyms
CCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)C(=O)NCC4=CC(=C(C=C4)OC)OC
InChI=1SC27H35N5O5Sc16311822(26(33)281721101124(364)25(1621)375)27(2931)38(3435)32141230(131532)2397819(2)20(23)3h7111618H6121517H215H3(H2833)
MFCD20753061
N((34dimethoxyphenyl)methyl)3(4(23dimethylphenyl)piperazin1yl)sulfonyl1ethylpyrazole4carboxamide
N(34dimethoxybenzyl)3((4(23dimethylphenyl)piperazin1yl)sulfonyl)1ethyl1Hpyrazole4carboxamide
ZINC000102920944
ZINC102920944
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