Vitas-M small molecule compound
(2E)-6-acetyl-5-(2-methoxynaphthalen-1-yl)-7-methyl-2-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one
Catalog ID
STK330216
SMILES COc1ccc2c(c1C1C(=C(C)N=c3n1c(=O)/c(=C\c1ccc(o1)c1ccc(cc1)[N+](=O)[O-])/s3)C(=O)C)cccc2
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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 C31H23N3O6S MW 565.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H23N3O6S/c1-17-27(18(2)35)29(28-23-7-5-4-6-19(23)10-14-25(28)39-3)33-30(36)26(41-31(33)32-17)16-22-13-15-24(40-22)20-8-11-21(12-9-20)34(37)38/h4-16,29H,1-3H3/b26-16+InChIKey
QGURROJJJCXAPP-WGOQTCKBSA-NSynonyms
(2E)6acetyl5(2methoxynaphthalen1yl)7methyl2((5(4nitrophenyl)furan2yl)methylidene)5H(13)thiazolo(32a)pyrimidin3(2H)one
(2E)6acetyl5(2methoxynaphthalen1yl)7methyl2((5(4nitrophenyl)furan2yl)methylidene)5H(13)thiazolo(32a)pyrimidin3one
CC1=C(C(N2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)(N+)(=O)(O))SC2=N1)C5=C(C=CC6=CC=CC=C65)OC)C(=O)C
COc1ccc2c(c1C1C(=C(C)N=c3n1c(=O)c(=Cc1ccc(o1)c1ccc(cc1)(N+)(=O)(O))s3)C(=O)C)cccc2
InChI=1SC31H23N3O6Sc11727(18(2)35)29(2823754619(23)101425(28)393)3330(36)26(4131(33)3217)1622131524(4022)2081121(12920)34(37)38h41629H13H3b2616+
MFCD01787402
ZINC000102035938
ZINC000102035945
Check stock
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