Vitas-M small molecule compound

ethyl N-{[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetyl}phenylalaninate

Catalog ID
STK777571
SMILES CCOC(=O)C(Cc1ccccc1)NC(=O)CSc1nnc2c(n1)n(C)c1c2cccc1

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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 C23H23N5O3S MW 449.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O3S/c1-3-31-22(30)17(13-15-9-5-4-6-10-15)24-19(29)14-32-23-25-21-20(26-27-23)16-11-7-8-12-18(16)28(21)2/h4-12,17H,3,13-14H2,1-2H3,(H,24,29)
InChIKey
IAYMMRZDTONQQU-UHFFFAOYSA-N
Synonyms

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)CSC2=NC3=C(C4=CC=CC=C4N3C)N=N2
ETHYL2((2((5METHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)3PHENYLPROPANOATE
ethylN(((5methyl5H(124)triazino(56b)indol3yl)sulfanyl)acetyl)phenylalaninate
InChI=1SC23H23N5O3Sc133122(30)17(131595461015)2419(29)143223252120(262723)1611781218(16)28(21)2h41217H31314H212H3(H2429)
MFCD05854634
ZINC000012412333
ZINC000012412335

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Available files

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