Vitas-M small molecule compound

(2Z)-6-benzyl-2-{[3-(4-methoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK705629
SMILES COc1ccc(cc1C)c1nn(cc1/C=c/1\sc2n(c1=O)nc(c(=O)n2)Cc1ccccc1)c1ccccc1

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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 C30H23N5O3S MW 533.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23N5O3S/c1-19-15-21(13-14-25(19)38-2)27-22(18-34(33-27)23-11-7-4-8-12-23)17-26-29(37)35-30(39-26)31-28(36)24(32-35)16-20-9-5-3-6-10-20/h3-15,17-18H,16H2,1-2H3/b26-17-
InChIKey
VOKUJVGDVVNRAG-ONUIUJJFSA-N
Synonyms

(2Z)6benzyl2((3(4methoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(2Z)6benzyl2((3(4methoxy3methylphenyl)1phenylpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazine37dione
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=O)C(=N4)CC5=CC=CC=C5)S3)C6=CC=CC=C6)OC
COc1ccc(cc1C)c1nn(cc1C=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccccc1)c1ccccc1
InChI=1SC30H23N5O3Sc1191521(131425(19)382)2722(1834(3327)23117481223)172629(37)3530(3926)3128(36)24(3235)162095361020h3151718H16H212H3b2617
MFCD03534660
ZINC000098046302
ZINC98046302

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Available files

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