Vitas-M small molecule compound

N-[(6,7-dimethoxyisoquinolin-1-yl)(3,4-dimethoxyphenyl)methyl]-5-methyl-2-phenyl-2H-1,2,3-triazole-4-carboxamide

Catalog ID
STK666608
SMILES COc1cc(ccc1OC)C(c1nccc2c1cc(OC)c(c2)OC)NC(=O)c1nn(nc1C)c1ccccc1

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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 C30H29N5O5 MW 539.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N5O5/c1-18-27(34-35(33-18)21-9-7-6-8-10-21)30(36)32-28(20-11-12-23(37-2)24(16-20)38-3)29-22-17-26(40-5)25(39-4)15-19(22)13-14-31-29/h6-17,28H,1-5H3,(H,32,36)
InChIKey
UCWQOEKUVVPKJZ-UHFFFAOYSA-N
Synonyms

CC1=NN(N=C1C(=O)NC(C2=CC(=C(C=C2)OC)OC)C3=NC=CC4=CC(=C(C=C43)OC)OC)C5=CC=CC=C5
InChI=1SC30H29N5O5c11827(3435(3318)2197681021)30(36)3228(20111223(372)24(1620)383)29221726(405)25(394)1519(22)13143129h61728H15H3(H3236)
MFCD10038592
N((67dimethoxyisoquinolin1yl)(34dimethoxyphenyl)methyl)5methyl2phenyl2H123triazole4carboxamide
N((67dimethoxyisoquinolin1yl)(34dimethoxyphenyl)methyl)5methyl2phenyltriazole4carboxamide
ZINC000100237883
ZINC000100237889

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Available files

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