Vitas-M small molecule compound

N-(2-{2-[(E)-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene}methyl]-1H-indol-3-yl}ethyl)-N-ethylacetamide

Catalog ID
STK582686
SMILES CCN(C(=O)C)CCc1c(/C=C/2\C(=O)NC(=O)N(C2=O)CCc2ccc(c(c2)OC)OC)[nH]c2c1cccc2

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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 C29H32N4O6 MW 532.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O6/c1-5-32(18(2)34)14-13-21-20-8-6-7-9-23(20)30-24(21)17-22-27(35)31-29(37)33(28(22)36)15-12-19-10-11-25(38-3)26(16-19)39-4/h6-11,16-17,30H,5,12-15H2,1-4H3,(H,31,35,37)/b22-17+
InChIKey
CZMCKUNNOZBYDI-OQKWZONESA-N
Synonyms

(E)N(2(2((1(34dimethoxyphenethyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)1Hindol3yl)ethyl)Nethylacetamide
CCN(C(=O)C)CCc1c(C=C2C(=O)NC(=O)N(C2=O)CCc2ccc(c(c2)OC)OC)(nH)c2c1cccc2
CCN(CCC1=C(NC2=CC=CC=C21)C=C3C(=O)NC(=O)N(C3=O)CCC4=CC(=C(C=C4)OC)OC)C(=O)C
InChI=1SC29H32N4O6c1532(18(2)34)14132120867923(20)3024(21)172227(35)3129(37)33(28(22)36)151219101125(383)26(1619)394h611161730H51215H214H3(H313537)b2217+
MFCD07639701
N(2(2((E)(1(2(34dimethoxyphenyl)ethyl)246trioxo13diazinan5ylidene)methyl)1Hindol3yl)ethyl)Nethylacetamide
N(2(2((E)(1(2(34dimethoxyphenyl)ethyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)1Hindol3yl)ethyl)Nethylacetamide
ZINC000101377887
ZINC101377887

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.