Vitas-M small molecule compound

2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK549395
SMILES COc1ccc(cc1)CNC(=O)c1c(N)n(c2c1nc1ccccc1n2)CCc1ccc(c(c1)OC)OC

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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 C29H29N5O4 MW 511.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N5O4/c1-36-20-11-8-19(9-12-20)17-31-29(35)25-26-28(33-22-7-5-4-6-21(22)32-26)34(27(25)30)15-14-18-10-13-23(37-2)24(16-18)38-3/h4-13,16H,14-15,17,30H2,1-3H3,(H,31,35)
InChIKey
XOAGVHCXVDWQNV-UHFFFAOYSA-N
Synonyms
376621-68-0
2AMINO1(2(34DIMETHOXYPHENYL)ETHYL)N((4METHOXYPHENYL)METHYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
2amino1(2(34dimethoxyphenyl)ethyl)N(4methoxybenzyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(34dimethoxyphenethyl)N(4methoxybenzyl)1Hpyrrolo(23b)quinoxaline3carboxamide
376621680
COC1=CC=C(C=C1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CCC5=CC(=C(C=C5)OC)OC)N
InChI=1SC29H29N5O4c1362011819(91220)173129(35)252628(3322754621(22)3226)34(27(25)30)151418101323(372)24(1618)383h41316H14151730H213H3(H3135)
MFCD02164602
ZINC000002233143
ZINC02233143
ZINC2233143

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Available files

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