Vitas-M small molecule compound
(2E)-2-cyano-3-(3-{3-[(3-methylpiperidin-1-yl)sulfonyl]phenyl}-1-phenyl-1H-pyrazol-4-yl)-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Catalog ID
STK905248
SMILES N#C/C(=C\c1cn(nc1c1cccc(c1)S(=O)(=O)N1CCCC(C1)C)c1ccccc1)/C(=O)NCC1CCCO1
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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 C30H33N5O4S MW 559.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N5O4S/c1-22-8-6-14-34(20-22)40(37,38)28-13-5-9-23(17-28)29-25(21-35(33-29)26-10-3-2-4-11-26)16-24(18-31)30(36)32-19-27-12-7-15-39-27/h2-5,9-11,13,16-17,21-22,27H,6-8,12,14-15,19-20H2,1H3,(H,32,36)/b24-16+InChIKey
SNPIJBMUFQYUAE-LFVJCYFKSA-NSynonyms
1025576-07-1(2E)2cyano3(3(3((3methylpiperidin1yl)sulfonyl)phenyl)1phenyl1Hpyrazol4yl)N(tetrahydrofuran2ylmethyl)prop2enamide
(E)2cyano3(3(3((3methylpiperidin1yl)sulfonyl)phenyl)1phenyl1Hpyrazol4yl)N((tetrahydrofuran2yl)methyl)acrylamide
(E)2cyano3(3(3(3methylpiperidin1yl)sulfonylphenyl)1phenylpyrazol4yl)N(oxolan2ylmethyl)prop2enamide
1025576071
CC1CCCN(C1)S(=O)(=O)C2=CC=CC(=C2)C3=NN(C=C3C=C(C#N)C(=O)NCC4CCCO4)C5=CC=CC=C5
InChI=1SC30H33N5O4Sc122861434(2022)40(3738)28135923(1728)2925(2135(3329)26103241126)1624(1831)30(36)321927127153927h25911131617212227H681214151920H21H3(H3236)b2416+
MFCD05732070
ZINC000097947406
ZINC000253390535
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