Vitas-M small molecule compound

7-({3-[(1,3-benzodioxol-5-ylmethyl)amino]propyl}amino)-3-tert-butyl-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione

Catalog ID
STK554458
SMILES O=c1c2ccccc2c(=O)c2c1c(NCCCNCc1ccc3c(c1)OCO3)cc1c2[nH]c2c(o1)cc(cc2)C(C)(C)C

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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 C35H33N3O5 MW 575.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H33N3O5/c1-35(2,3)21-10-11-24-27(16-21)43-29-17-25(37-14-6-13-36-18-20-9-12-26-28(15-20)42-19-41-26)30-31(32(29)38-24)34(40)23-8-5-4-7-22(23)33(30)39/h4-5,7-12,15-17,36-38H,6,13-14,18-19H2,1-3H3
InChIKey
DXMSIXPWVUJLGJ-UHFFFAOYSA-N
Synonyms

7((3((13benzodioxol5ylmethyl)amino)propyl)amino)3tertbutyl8Hnaphtho(23a)phenoxazine813(14H)dione
7((3((benzo(d)(13)dioxol5ylmethyl)amino)propyl)amino)3(tertbutyl)8Hnaphtho(23a)phenoxazine813(14H)dione
7(3(13BENZODIOXOL5YLMETHYLAMINO)PROPYLAMINO)3TERTBUTYL14HNAPHTHO(32A)PHENOXAZINE813DIONE
CC(C)(C)C1=CC2=C(C=C1)NC3=C(O2)C=C(C4=C3C(=O)C5=CC=CC=C5C4=O)NCCCNCC6=CC7=C(C=C6)OCO7
InChI=1SC35H33N3O5c135(23)2110112427(1621)43291725(37146133618209122628(1520)42194126)3031(32(29)3824)34(40)23854722(23)33(30)39h4571215173638H613141819H213H3
MFCD04005771
O=c1c2ccccc2c(=O)c2c1c(NCCCNCc1ccc3c(c1)OCO3)cc1c2(nH)c2c(o1)cc(cc2)C(C)(C)C
ZINC000101762760

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Available files

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