Vitas-M small molecule compound

ethyl 1-{2-[(3-tert-butyl-8,13-dioxo-13,14-dihydro-8H-naphtho[2,3-a]phenoxazin-7-yl)amino]ethyl}piperidine-3-carboxylate

Catalog ID
STK548025
SMILES CCOC(=O)C1CCCN(C1)CCNc1cc2oc3cc(ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1)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 C34H37N3O5 MW 567.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H37N3O5/c1-5-41-33(40)20-9-8-15-37(19-20)16-14-35-25-18-27-30(36-24-13-12-21(34(2,3)4)17-26(24)42-27)29-28(25)31(38)22-10-6-7-11-23(22)32(29)39/h6-7,10-13,17-18,20,35-36H,5,8-9,14-16,19H2,1-4H3
InChIKey
JMDJFLPCXIDHKZ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1CCCN(C1)CCNc1cc2oc3cc(ccc3(nH)c2c2c1c(=O)c1c(c2=O)cccc1)C(C)(C)C
CCOC(=O)C1CCCN(C1)CCNC2=CC3=C(C4=C2C(=O)C5=CC=CC=C5C4=O)NC6=C(O3)C=C(C=C6)C(C)(C)C
ethyl1(2((3(tertbutyl)813dioxo1314dihydro8Hnaphtho(23a)phenoxazin7yl)amino)ethyl)piperidine3carboxylate
ethyl1(2((3tertbutyl813dioxo1314dihydro8Hnaphtho(23a)phenoxazin7yl)amino)ethyl)piperidine3carboxylate
ETHYL1(2((3TERTBUTYL813DIOXO14HNAPHTHO(23A)PHENOXAZIN7YL)AMINO)ETHYL)PIPERIDINE3CARBOXYLATE
InChI=1SC34H37N3O5c154133(40)20981537(1920)16143525182730(3624131221(34(23)4)1726(24)4227)2928(25)31(38)2210671123(22)32(29)39h6710131718203536H589141619H214H3
MFCD03663357
ZINC000102449547
ZINC000102449550

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Available files

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