Vitas-M small molecule compound

(2Z)-6-(3,4-dimethoxybenzyl)-2-(1-heptyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK554584
SMILES CCCCCCCN1c2ccccc2/C(=c\2/sc3n(c2=O)nc(c(=O)n3)Cc2ccc(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 C29H30N4O5S MW 546.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N4O5S/c1-4-5-6-7-10-15-32-21-12-9-8-11-19(21)24(27(32)35)25-28(36)33-29(39-25)30-26(34)20(31-33)16-18-13-14-22(37-2)23(17-18)38-3/h8-9,11-14,17H,4-7,10,15-16H2,1-3H3/b25-24-
InChIKey
NEBLEGKIRLEJOO-IZHYLOQSSA-N
Synonyms
638133-63-8
(2Z)6((34DIMETHOXYPHENYL)METHYL)2(1HEPTYL2OXOINDOL3YLIDENE)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)6(34dimethoxybenzyl)2(1heptyl2oxo12dihydro3Hindol3ylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)6(34dimethoxybenzyl)2(1heptyl2oxoindolin3ylidene)2Hthiazolo(32b)(124)triazine37dione
6((34DIMETHOXYPHENYL)METHYL)2(1HEPTYL2OXOBENZO(D)AZOLIN3YLIDENE)13THIAZOLIDINO(32B)124TRIAZINE37DIONE
638133638
CCCCCCCN1C2=CC=CC=C2C(=C3C(=O)N4C(=NC(=O)C(=N4)CC5=CC(=C(C=C5)OC)OC)S3)C1=O
CCCCCCCN1c2ccccc2C(=c2sc3n(c2=O)nc(c(=O)n3)Cc2ccc(c(c2)OC)OC)C1=O
InChI=1SC29H30N4O5Sc145671015322112981119(21)24(27(32)35)2528(36)3329(3925)3026(34)20(3133)1618131422(372)23(1718)383h89111417H47101516H213H3b2524
MFCD04005976
ZINC000100870445
ZINC100870445

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Available files

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