Vitas-M small molecule compound

4-acetyl-3-hydroxy-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one

Catalog ID
STK774017
SMILES CC(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])CCc1c(C)[nH]c2c1cccc2

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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 C23H21N3O5 MW 419.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O5/c1-13-17(18-8-3-4-9-19(18)24-13)10-11-25-21(20(14(2)27)22(28)23(25)29)15-6-5-7-16(12-15)26(30)31/h3-9,12,21,24,28H,10-11H2,1-2H3
InChIKey
XVHLETKJUXVTSH-UHFFFAOYSA-N
Synonyms

(5R)4ACETYL3HYDROXY1(2(2METHYL1HINDOL3YL)ETHYL)5(3NITROPHENYL)15DIHYDRO2HPYRROL2ONE
(5S)4ACETYL3HYDROXY1(2(2METHYL1HINDOL3YL)ETHYL)5(3NITROPHENYL)15DIHYDRO2HPYRROL2ONE
3ACETYL4HYDROXY1(2(2METHYL1HINDOL3YL)ETHYL)2(3NITROPHENYL)2HPYRROL5ONE
3ACETYL4HYDROXY1(2(2METHYLINDOL3YL)ETHYL)2(3NITROPHENYL)5OXO3PYRROLINE
4acetyl3hydroxy1(2(2methyl1Hindol3yl)ethyl)5(3nitrophenyl)15dihydro2Hpyrrol2one
CC(=O)C1=C(O)C(=O)N(C1c1cccc(c1)(N+)(=O)(O))CCc1c(C)(nH)c2c1cccc2
CC1=C(C2=CC=CC=C2N1)CCN3C(C(=C(C3=O)O)C(=O)C)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC23H21N3O5c11317(18834919(18)2413)10112521(20(14(2)27)22(28)23(25)29)1565716(1215)26(30)31h3912212428H1011H212H3
MFCD03855969
ZINC000001440749
ZINC000001440750

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Available files

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