Vitas-M small molecule compound

(2Z)-6-(3,4-dimethoxybenzyl)-2-(naphthalen-1-ylmethylidene)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK558175
SMILES COc1ccc(cc1OC)Cc1nn2c(nc1=O)s/c(=C\c1cccc3c1cccc3)/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 C25H19N3O4S MW 457.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N3O4S/c1-31-20-11-10-15(13-21(20)32-2)12-19-23(29)26-25-28(27-19)24(30)22(33-25)14-17-8-5-7-16-6-3-4-9-18(16)17/h3-11,13-14H,12H2,1-2H3/b22-14-
InChIKey
GGHXHRKVOMLJHN-HMAPJEAMSA-N
Synonyms
585557-24-0
(2Z)6((34DIMETHOXYPHENYL)METHYL)2(NAPHTHALEN1YLMETHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)6(34dimethoxybenzyl)2(naphthalen1ylmethylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)6(34dimethoxybenzyl)2(naphthalen1ylmethylene)2Hthiazolo(32b)(124)triazine37dione
585557240
6((34DIMETHOXYPHENYL)METHYL)2(NAPHTHYLMETHYLENE)13THIAZOLIDINO(32B)124TRIAZINE37DIONE
COC1=C(C=C(C=C1)CC2=NN3C(=O)C(=CC4=CC=CC5=CC=CC=C54)SC3=NC2=O)OC
COc1ccc(cc1OC)Cc1nn2c(nc1=O)sc(=Cc1cccc3c1cccc3)c2=O
InChI=1SC25H19N3O4Sc13120111015(1321(20)322)121923(29)262528(2719)24(30)22(3325)141785716634918(16)17h3111314H12H212H3b2214
MFCD04030549
ZINC000001452002
ZINC01452002
ZINC1452002

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.