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-heptyl-1,3-dihydro-2H-indol-2-one

Catalog ID
STK819916
SMILES CCCCCCCN1c2ccccc2/C(=c\2/sc3n(c2=O)nc(n3)c2ccc(c(c2)OC)OC)/C1=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 C27H28N4O4S MW 504.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O4S/c1-4-5-6-7-10-15-30-19-12-9-8-11-18(19)22(25(30)32)23-26(33)31-27(36-23)28-24(29-31)17-13-14-20(34-2)21(16-17)35-3/h8-9,11-14,16H,4-7,10,15H2,1-3H3/b23-22-
InChIKey
QZAGDSCOFWUTJV-FCQUAONHSA-N
Synonyms
573944-56-6
(3Z)3(2(34dimethoxyphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)1heptyl13dihydro2Hindol2one
(5Z)2(34DIMETHOXYPHENYL)5(1HEPTYL2OXOINDOL3YLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)2(34dimethoxyphenyl)5(1heptyl2oxoindolin3ylidene)thiazolo(32b)(124)triazol6(5H)one
573944566
CCCCCCCN1C2=CC=CC=C2C(=C3C(=O)N4C(=NC(=N4)C5=CC(=C(C=C5)OC)OC)S3)C1=O
CCCCCCCN1c2ccccc2C(=c2sc3n(c2=O)nc(n3)c2ccc(c(c2)OC)OC)C1=O
InChI=1SC27H28N4O4Sc145671015301912981118(19)22(25(30)32)2326(33)3127(3623)2824(2931)17131420(342)21(1617)353h89111416H471015H213H3b2322
MFCD04020826
ZINC000100947984
ZINC100947984

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Available files

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