Vitas-M small molecule compound
(2E)-2-cyano-N-[3-(1H-imidazol-1-yl)propyl]-3-{1-phenyl-3-[3-(pyrrolidin-1-ylsulfonyl)phenyl]-1H-pyrazol-4-yl}prop-2-enamide
Catalog ID
STK707316
SMILES N#C/C(=C\c1cn(nc1c1cccc(c1)S(=O)(=O)N1CCCC1)c1ccccc1)/C(=O)NCCCn1cncc1
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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 C29H29N7O3S MW 555.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N7O3S/c30-20-24(29(37)32-12-7-14-34-17-13-31-22-34)18-25-21-36(26-9-2-1-3-10-26)33-28(25)23-8-6-11-27(19-23)40(38,39)35-15-4-5-16-35/h1-3,6,8-11,13,17-19,21-22H,4-5,7,12,14-16H2,(H,32,37)/b24-18+InChIKey
FSJLVPDPDGXOEC-HKOYGPOVSA-NSynonyms
(2E)2cyanoN(3(1Himidazol1yl)propyl)3(1phenyl3(3(pyrrolidin1ylsulfonyl)phenyl)1Hpyrazol4yl)prop2enamide
(E)2CYANON(3IMIDAZOL1YLPROPYL)3(1PHENYL3(3PYRROLIDIN1YLSULFONYLPHENYL)PYRAZOL4YL)PROP2ENAMIDE
(E)N(3(1Himidazol1yl)propyl)2cyano3(1phenyl3(3(pyrrolidin1ylsulfonyl)phenyl)1Hpyrazol4yl)acrylamide
C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C3=NN(C=C3C=C(C#N)C(=O)NCCCN4C=CN=C4)C5=CC=CC=C5
InChI=1SC29H29N7O3Sc302024(29(37)3212714341713312234)18252136(2692131026)3328(25)23861127(1923)40(3839)3515451635h1368111317192122H457121416H2(H3237)b2418+
MFCD04179021
N#CC(=Cc1cn(nc1c1cccc(c1)S(=O)(=O)N1CCCC1)c1ccccc1)C(=O)NCCCn1cncc1
ZINC000097947308
ZINC97947308
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