Vitas-M small molecule compound

(2Z)-6-(4-methoxybenzyl)-2-({3-[3-methyl-4-(propan-2-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK817459
SMILES COc1ccc(cc1)Cc1nn2c(nc1=O)s/c(=C\c1cn(nc1c1ccc(c(c1)C)OC(C)C)c1ccccc1)/c2=O

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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 C33H29N5O4S MW 591.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29N5O4S/c1-20(2)42-28-15-12-23(16-21(28)3)30-24(19-37(36-30)25-8-6-5-7-9-25)18-29-32(40)38-33(43-29)34-31(39)27(35-38)17-22-10-13-26(41-4)14-11-22/h5-16,18-20H,17H2,1-4H3/b29-18-
InChIKey
SISDVRRTZNAPNZ-MIXAMLLLSA-N
Synonyms
956046-01-8
(2Z)6((4METHOXYPHENYL)METHYL)2((3(3METHYL4PROPAN2YLOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)6(4methoxybenzyl)2((3(3methyl4(propan2yloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)2((3(4isopropoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)6(4methoxybenzyl)2Hthiazolo(32b)(124)triazine37dione
956046018
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=O)C(=N4)CC5=CC=C(C=C5)OC)S3)C6=CC=CC=C6)OC(C)C
COc1ccc(cc1)Cc1nn2c(nc1=O)sc(=Cc1cn(nc1c1ccc(c(c1)C)OC(C)C)c1ccccc1)c2=O
InChI=1SC33H29N5O4Sc120(2)4228151223(1621(28)3)3024(1937(3630)258657925)182932(40)3833(4329)3431(39)27(3538)1722101326(414)141122h5161820H17H214H3b2918
MFCD05725045
ZINC000001871717
ZINC01871717
ZINC1871717

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Available files

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