Vitas-M small molecule compound

N-[2-(1H-indol-3-yl)ethyl]-N~2~-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}alaninamide

Catalog ID
STL467508
SMILES O=C(NC(C(=O)NCCc1c[nH]c2c1cccc2)C)COc1ccc2c(c1)oc(=O)cc2C

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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 C25H25N3O5 MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O5/c1-15-11-24(30)33-22-12-18(7-8-19(15)22)32-14-23(29)28-16(2)25(31)26-10-9-17-13-27-21-6-4-3-5-20(17)21/h3-8,11-13,16,27H,9-10,14H2,1-2H3,(H,26,31)(H,28,29)
InChIKey
HUTWVQWLANZGSN-UHFFFAOYSA-N
Synonyms

(S)N(2(1Hindol3yl)ethyl)2(2((4methyl2oxo2Hchromen7yl)oxy)acetamido)propanamide
CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC(C)C(=O)NCCC3=CNC4=CC=CC=C43
InChI=1SC25H25N3O5c1151124(30)33221218(7819(15)22)321423(29)2816(2)25(31)2610917132721643520(17)21h3811131627H91014H212H3(H2631)(H2829)
MFCD29692614
N(2(1Hindol3yl)ethyl)2((2(4methyl2oxochromen7yl)oxyacetyl)amino)propanamide
N(2(1Hindol3yl)ethyl)N~2~(((4methyl2oxo2Hchromen7yl)oxy)acetyl)alaninamide
N(2(1HINDOL3YL)ETHYL)N2(((4METHYL2OXO2HCHROMEN7YL)OXY)ACETYL)ALANINAMIDE
O=C(N(C@H)(C(=O)NCCc1c(nH)c2c1cccc2)C)COc1ccc2c(c1)oc(=O)cc2C
O=C(NC(C(=O)NCCc1c(nH)c2c1cccc2)C)COc1ccc2c(c1)oc(=O)cc2C
ZINC000012296310
ZINC000098038057

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Available files

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