Vitas-M small molecule compound

N,N-diethyl-3-(4-{(Z)-[2-(morpholin-4-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}-1-phenyl-1H-pyrazol-3-yl)benzenesulfonamide

Catalog ID
STL050231
SMILES CCN(S(=O)(=O)c1cccc(c1)c1nn(cc1/C=C/1\SC(=NC1=O)N1CCOCC1)c1ccccc1)CC

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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 C27H29N5O4S2 MW 551.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O4S2/c1-3-31(4-2)38(34,35)23-12-8-9-20(17-23)25-21(19-32(29-25)22-10-6-5-7-11-22)18-24-26(33)28-27(37-24)30-13-15-36-16-14-30/h5-12,17-19H,3-4,13-16H2,1-2H3/b24-18-
InChIKey
WKCVICSWWUAUAE-MOHJPFBDSA-N
Synonyms

(Z)NNdiethyl3(4((2morpholino4oxothiazol5(4H)ylidene)methyl)1phenyl1Hpyrazol3yl)benzenesulfonamide
CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCOCC4)C5=CC=CC=C5
CCN(S(=O)(=O)c1cccc(c1)c1nn(cc1C=C1SC(=NC1=O)N1CCOCC1)c1ccccc1)CC
InChI=1SC27H29N5O4S2c1331(42)38(3435)23128920(1723)2521(1932(2925)22106571122)182426(33)2827(3724)30131536161430h5121719H341316H212H3b2418
MFCD04156363
NNdiethyl3(4((Z)(2(morpholin4yl)4oxo13thiazol5(4H)ylidene)methyl)1phenyl1Hpyrazol3yl)benzenesulfonamide
NNDIETHYL3(4((Z)(2MORPHOLIN4YL4OXO13THIAZOL5YLIDENE)METHYL)1PHENYLPYRAZOL3YL)BENZENESULFONAMIDE
ZINC000001279196
ZINC000097947622
ZINC97947622

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Available files

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