Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-{1-phenyl-3-[4-(piperidin-1-ylsulfonyl)phenyl]-1H-pyrazol-4-yl}prop-2-enenitrile
Catalog ID
STK815189
SMILES N#C/C(=C\c1cn(nc1c1ccc(cc1)S(=O)(=O)N1CCCCC1)c1ccccc1)/c1nc2c([nH]1)cccc2
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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 C30H26N6O2S MW 534.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N6O2S/c31-20-23(30-32-27-11-5-6-12-28(27)33-30)19-24-21-36(25-9-3-1-4-10-25)34-29(24)22-13-15-26(16-14-22)39(37,38)35-17-7-2-8-18-35/h1,3-6,9-16,19,21H,2,7-8,17-18H2,(H,32,33)/b23-19+InChIKey
GXTBJJZMOIXQBO-FCDQGJHFSA-NSynonyms
(2E)2(1Hbenzimidazol2yl)3(1phenyl3(4(piperidin1ylsulfonyl)phenyl)1Hpyrazol4yl)prop2enenitrile
(E)2(1HBENZIMIDAZOL2YL)3(1PHENYL3(4PIPERIDIN1YLSULFONYLPHENYL)PYRAZOL4YL)PROP2ENENITRILE
C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=NN(C=C3C=C(C#N)C4=NC5=CC=CC=C5N4)C6=CC=CC=C6
InChI=1SC30H26N6O2Sc312023(30322711561228(27)3330)19242136(2593141025)3429(24)22131526(161422)39(3738)35177281835h1369161921H2781718H2(H3233)b2319+
MFCD04442561
N#CC(=Cc1cn(nc1c1ccc(cc1)S(=O)(=O)N1CCCCC1)c1ccccc1)c1nc2c((nH)1)cccc2
ZINC000100893550
ZINC100893550
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