Vitas-M small molecule compound
(2Z)-6-benzyl-2-[3-methoxy-4-(octyloxy)benzylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK817280
SMILES CCCCCCCCOc1ccc(cc1OC)/C=c/1\sc2n(c1=O)nc(c(=O)n2)Cc1ccccc1
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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 C28H31N3O4S MW 505.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O4S/c1-3-4-5-6-7-11-16-35-23-15-14-21(18-24(23)34-2)19-25-27(33)31-28(36-25)29-26(32)22(30-31)17-20-12-9-8-10-13-20/h8-10,12-15,18-19H,3-7,11,16-17H2,1-2H3/b25-19-InChIKey
BAVOVIUIYBUGNV-PLRJNAJWSA-NSynonyms
797770-00-4(2Z)6BENZYL2((3METHOXY4OCTOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)6benzyl2(3methoxy4(octyloxy)benzylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)6benzyl2(3methoxy4(octyloxy)benzylidene)2Hthiazolo(32b)(124)triazine37dione
797770004
CCCCCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=O)C(=N3)CC4=CC=CC=C4)S2)OC
CCCCCCCCOc1ccc(cc1OC)C=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccccc1
InChI=1SC28H31N3O4Sc13456711163523151421(1824(23)342)192527(33)3128(3625)2926(32)22(3031)17201298101320h81012151819H37111617H212H3b2519
MFCD03665623
ZINC000100896452
ZINC100896452
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