Vitas-M small molecule compound
(2Z)-2-({1-phenyl-3-[3-(pyrrolidin-1-ylsulfonyl)phenyl]-1H-pyrazol-4-yl}methylidene)[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK904186
SMILES O=c1/c(=C/c2cn(nc2c2cccc(c2)S(=O)(=O)N2CCCC2)c2ccccc2)/sc2n1c1ccccc1n2
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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 C29H23N5O3S2 MW 553.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N5O3S2/c35-28-26(38-29-30-24-13-4-5-14-25(24)34(28)29)18-21-19-33(22-10-2-1-3-11-22)31-27(21)20-9-8-12-23(17-20)39(36,37)32-15-6-7-16-32/h1-5,8-14,17-19H,6-7,15-16H2/b26-18-InChIKey
VCBRBMHJKRMHEN-ITYLOYPMSA-NSynonyms
(2Z)2((1phenyl3(3(pyrrolidin1ylsulfonyl)phenyl)1Hpyrazol4yl)methylidene)(13)thiazolo(32a)benzimidazol3(2H)one
(2Z)2((1PHENYL3(3PYRROLIDIN1YLSULFONYLPHENYL)PYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(Z)2((1phenyl3(3(pyrrolidin1ylsulfonyl)phenyl)1Hpyrazol4yl)methylene)benzo(45)imidazo(21b)thiazol3(2H)one
C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C3=NN(C=C3C=C4C(=O)N5C6=CC=CC=C6N=C5S4)C7=CC=CC=C7
InChI=1SC29H23N5O3S2c352826(3829302413451425(24)34(28)29)18211933(22102131122)3127(21)20981223(1720)39(3637)3215671632h158141719H671516H2b2618
MFCD04155936
O=c1c(=Cc2cn(nc2c2cccc(c2)S(=O)(=O)N2CCCC2)c2ccccc2)sc2n1c1ccccc1n2
ZINC000006161701
ZINC6161701
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