Vitas-M small molecule compound

ethyl 6'-amino-1-{2-[(3-chlorophenyl)amino]-2-oxoethyl}-5'-cyano-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate

Catalog ID
STK688660
SMILES CCOC(=O)C1=C(C)OC(=C(C21C(=O)N(c1c2cccc1)CC(=O)Nc1cccc(c1)Cl)C#N)N

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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 C25H21ClN4O5 MW 492.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN4O5/c1-3-34-23(32)21-14(2)35-22(28)18(12-27)25(21)17-9-4-5-10-19(17)30(24(25)33)13-20(31)29-16-8-6-7-15(26)11-16/h4-11H,3,13,28H2,1-2H3,(H,29,31)
InChIKey
OBWODKLMNIJPBW-UHFFFAOYSA-N
Synonyms
CCOC(=O)C1=C(OC(=C(C12C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC(=CC=C4)Cl)C#N)N)C
ethyl6amino1(2((3chlorophenyl)amino)2oxoethyl)5cyano2methyl2oxo12dihydrospiro(indole34pyran)3carboxylate
ETHYL6AMINO1(2(3CHLOROANILINO)2OXOETHYL)5CYANO2METHYL2OXOSPIRO(INDOLE34PYRAN)3CARBOXYLATE
Registry IDs
MFCD07657981
ZINC000012412702
ZINC000012412704

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Available files

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