Vitas-M small molecule compound
N-[(1Z)-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-(4-methylpiperazin-1-yl)-3-oxoprop-1-en-2-yl]-2-fluorobenzamide
Catalog ID
STL483042
SMILES CN1CCN(CC1)C(=O)/C(=C/c1cn(c2c1cccc2)S(=O)(=O)N(C)C)/NC(=O)c1ccccc1F
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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 C25H28FN5O4S MW 513.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28FN5O4S/c1-28(2)36(34,35)31-17-18(19-8-5-7-11-23(19)31)16-22(25(33)30-14-12-29(3)13-15-30)27-24(32)20-9-4-6-10-21(20)26/h4-11,16-17H,12-15H2,1-3H3,(H,27,32)/b22-16-InChIKey
UUIDUDBDMJQGPA-JWGURIENSA-NSynonyms
CN1CCN(CC1)C(=O)C(=Cc1cn(c2c1cccc2)S(=O)(=O)N(C)C)NC(=O)c1ccccc1F
CN1CCN(CC1)C(=O)C(=CC2=CN(C3=CC=CC=C32)S(=O)(=O)N(C)C)NC(=O)C4=CC=CC=C4F
InChI=1SC25H28FN5O4Sc128(2)36(3435)311718(198571123(19)31)1622(25(33)30141229(3)131530)2724(32)209461021(20)26h4111617H1215H213H3(H2732)b2216
MFCD06240896
N((1Z)1(1(dimethylsulfamoyl)1Hindol3yl)3(4methylpiperazin1yl)3oxoprop1en2yl)2fluorobenzamide
N((Z)1(1(dimethylsulfamoyl)indol3yl)3(4methylpiperazin1yl)3oxoprop1en2yl)2fluorobenzamide
ZINC000025180719
ZINC25180719
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