Vitas-M small molecule compound
4-{[(7Z)-7-benzylidene-3-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]carbonyl}-N-(propan-2-yl)benzenesulfonamide
Catalog ID
STK889235
SMILES CC(NS(=O)(=O)c1ccc(cc1)C(=O)N1N=C2C(C1c1ccccc1)CCC/C/2=C/c1ccccc1)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 C30H31N3O3S MW 513.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N3O3S/c1-21(2)32-37(35,36)26-18-16-24(17-19-26)30(34)33-29(23-12-7-4-8-13-23)27-15-9-14-25(28(27)31-33)20-22-10-5-3-6-11-22/h3-8,10-13,16-21,27,29,32H,9,14-15H2,1-2H3/b25-20-InChIKey
UGLKXQPAMIIDJC-QQTULTPQSA-NSynonyms
4(((7Z)7benzylidene3phenyl33a4567hexahydro2Hindazol2yl)carbonyl)N(propan2yl)benzenesulfonamide
4((7Z)7benzylidene3phenyl3a456tetrahydro3Hindazole2carbonyl)Npropan2ylbenzenesulfonamide
CC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)N2C(C3CCCC(=CC4=CC=CC=C4)C3=N2)C5=CC=CC=C5
CC(NS(=O)(=O)c1ccc(cc1)C(=O)N1N=C2C(C1c1ccccc1)CCCC2=Cc1ccccc1)C
InChI=1SC30H31N3O3Sc121(2)3237(3536)26181624(171926)30(34)3329(23127481323)271591425(28(27)3133)2022105361122h3810131621272932H91415H212H3b2520
MFCD18172101
ZINC000033788444
ZINC000040487505
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