Vitas-M small molecule compound

ethyl 4-(5-{(Z)-[2-(3-methylphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}furan-2-yl)benzoate

Catalog ID
STK799447
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=c/1\sc2n(c1=O)nc(n2)c1cccc(c1)C

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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/c1-3-31-24(30)17-9-7-16(8-10-17)20-12-11-19(32-20)14-21-23(29)28-25(33-21)26-22(27-28)18-6-4-5-15(2)13-18/h4-14H,3H2,1-2H3/b21-14-
InChIKey
RPRQQKQJUJOKRV-STZFKDTASA-N
Synonyms
585563-15-1
(Z)ethyl4(5((6oxo2(mtolyl)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)furan2yl)benzoate
585563151
CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C(=O)N4C(=NC(=N4)C5=CC(=CC=C5)C)S3
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=c1sc2n(c1=O)nc(n2)c1cccc(c1)C
ethyl4(5((Z)(2(3methylphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)furan2yl)benzoate
ETHYL4(5((Z)(2(3METHYLPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)FURAN2YL)BENZOATE
InChI=1SC25H19N3O4Sc133124(30)179716(81017)20121119(3220)142123(29)2825(3321)2622(2728)1864515(2)1318h414H3H212H3b2114
MFCD04030800
ZINC000013757405
ZINC13757405

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Available files

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