Vitas-M small molecule compound
(2E)-3-(1-butyl-1H-indol-3-yl)-2-(phenylsulfonyl)prop-2-enenitrile
Catalog ID
STK445257
SMILES CCCCn1cc(c2c1cccc2)/C=C(/S(=O)(=O)c1ccccc1)\C#N
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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 C21H20N2O2S MW 364.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O2S/c1-2-3-13-23-16-17(20-11-7-8-12-21(20)23)14-19(15-22)26(24,25)18-9-5-4-6-10-18/h4-12,14,16H,2-3,13H2,1H3/b19-14+InChIKey
ADRWKQCZSCGELI-XMHGGMMESA-NSynonyms
(2E)3(1butyl1Hindol3yl)2(phenylsulfonyl)prop2enenitrile
(2E)3(1BUTYLINDOL3YL)2(PHENYLSULFONYL)PROP2ENENITRILE
(E)2(benzenesulfonyl)3(1butylindol3yl)prop2enenitrile
CCCCN1C=C(C2=CC=CC=C21)C=C(C#N)S(=O)(=O)C3=CC=CC=C3
CCCCn1cc(c2c1cccc2)C=C(S(=O)(=O)c1ccccc1)C#N
InChI=1SC21H20N2O2Sc12313231617(2011781221(20)23)1419(1522)26(2425)1895461018h4121416H2313H21H3b1914+
MFCD04057919
ZINC000017074950
ZINC17074950
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