Vitas-M small molecule compound

(2Z)-2-[3-methoxy-4-(pentyloxy)benzylidene]-6-(4-propoxybenzyl)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK819788
SMILES CCCCCOc1ccc(cc1OC)/C=c/1\sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)OCCC

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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 C28H31N3O5S MW 521.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O5S/c1-4-6-7-15-36-23-13-10-20(17-24(23)34-3)18-25-27(33)31-28(37-25)29-26(32)22(30-31)16-19-8-11-21(12-9-19)35-14-5-2/h8-13,17-18H,4-7,14-16H2,1-3H3/b25-18-
InChIKey
AVMWQXIGTGEDSI-BWAHOGKJSA-N
Synonyms
620540-34-3
(2Z)2((3METHOXY4PENTOXYPHENYL)METHYLIDENE)6((4PROPOXYPHENYL)METHYL)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)2(3methoxy4(pentyloxy)benzylidene)6(4propoxybenzyl)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)2(3methoxy4(pentyloxy)benzylidene)6(4propoxybenzyl)2Hthiazolo(32b)(124)triazine37dione
620540343
CCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=O)C(=N3)CC4=CC=C(C=C4)OCCC)S2)OC
CCCCCOc1ccc(cc1OC)C=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccc(cc1)OCCC
InChI=1SC28H31N3O5Sc1467153623131020(1724(23)343)182527(33)3128(3725)2926(32)22(3031)161981121(12919)351452h8131718H471416H213H3b2518
MFCD05686747
ZINC000013805301
ZINC13805301

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Available files

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