Vitas-M small molecule compound

(3Z)-3-[2-(3,4-dimethoxyphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1-methyl-1,3-dihydro-2H-indol-2-one

Catalog ID
STK850661
SMILES COc1cc(ccc1OC)c1nn2c(n1)s/c(=C\1/c3ccccc3N(C1=O)C)/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 C21H16N4O4S MW 420.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N4O4S/c1-24-13-7-5-4-6-12(13)16(19(24)26)17-20(27)25-21(30-17)22-18(23-25)11-8-9-14(28-2)15(10-11)29-3/h4-10H,1-3H3/b17-16-
InChIKey
NRMXXJFBSAEZKJ-MSUUIHNZSA-N
Synonyms
618854-26-5
(3Z)3(2(34dimethoxyphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)1methyl13dihydro2Hindol2one
(5Z)2(34DIMETHOXYPHENYL)5(1METHYL2OXOINDOL3YLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)2(34dimethoxyphenyl)5(1methyl2oxoindolin3ylidene)thiazolo(32b)(124)triazol6(5H)one
618854265
CN1C2=CC=CC=C2C(=C3C(=O)N4C(=NC(=N4)C5=CC(=C(C=C5)OC)OC)S3)C1=O
COc1cc(ccc1OC)c1nn2c(n1)sc(=C1c3ccccc3N(C1=O)C)c2=O
InChI=1SC21H16N4O4Sc12413754612(13)16(19(24)26)1720(27)2521(3017)2218(2325)118914(282)15(1011)293h410H13H3b1716
MFCD04007254
ZINC000002264526
ZINC02264526
ZINC2264526

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Available files

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