Vitas-M small molecule compound

N-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-1-(3,4,5-trimethoxyphenyl)ethyl]-2-(1H-benzotriazol-1-yl)-N-(2-methylbenzyl)acetamide

Catalog ID
STL446754
SMILES COc1c(OC)cc(cc1OC)C(N(C(=O)Cn1nnc2c1cccc2)Cc1ccccc1C)C(=O)Nc1ccc2c(c1)OCO2

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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 C34H33N5O7 MW 623.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H33N5O7/c1-21-9-5-6-10-22(21)18-38(31(40)19-39-26-12-8-7-11-25(26)36-37-39)32(23-15-29(42-2)33(44-4)30(16-23)43-3)34(41)35-24-13-14-27-28(17-24)46-20-45-27/h5-17,32H,18-20H2,1-4H3,(H,35,41)
InChIKey
QFIVSSVVDCCOHZ-UHFFFAOYSA-N
Synonyms

2(2(1HBENZO(D)(123)TRIAZOL1YL)N(2METHYLBENZYL)ACETAMIDO)N(BENZO(D)(13)DIOXOL5YL)2(345TRIMETHOXYPHENYL)ACETAMIDE
CC1=CC=CC=C1CN(C(C2=CC(=C(C(=C2)OC)OC)OC)C(=O)NC3=CC4=C(C=C3)OCO4)C(=O)CN5C6=CC=CC=C6N=N5
InChI=1SC34H33N5O7c1219561022(21)1838(31(40)19392612871125(26)363739)32(231529(422)33(444)30(1623)433)34(41)352413142728(1724)46204527h51732H1820H214H3(H3541)
MFCD06244371
N(13BENZODIOXOL5YL)2((2(BENZOTRIAZOL1YL)ACETYL)((2METHYLPHENYL)METHYL)AMINO)2(345TRIMETHOXYPHENYL)ACETAMIDE
N(2(13benzodioxol5ylamino)2oxo1(345trimethoxyphenyl)ethyl)2(1Hbenzotriazol1yl)N(2methylbenzyl)acetamide
ZINC000008713019
ZINC000008713021

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Available files

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