Vitas-M small molecule compound
methyl 2-({2-[(1,4-dioxo-1,2,3,4-tetrahydrophthalazin-5-yl)amino]-2-oxoethyl}sulfanyl)benzoate
Catalog ID
STK666142
SMILES COC(=O)c1ccccc1SCC(=O)Nc1cccc2c1c(=O)[nH][nH]c2=O
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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 C18H15N3O5S MW 385.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O5S/c1-26-18(25)10-5-2-3-8-13(10)27-9-14(22)19-12-7-4-6-11-15(12)17(24)21-20-16(11)23/h2-8H,9H2,1H3,(H,19,22)(H,20,23)(H,21,24)InChIKey
DDSWIFFVHQQVFS-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=CC=C1SCC(=O)NC2=CC=CC3=C2C(=O)NNC3=O
COC(=O)c1ccccc1SCC(=O)Nc1cccc2c1c(=O)(nH)(nH)c2=O
InChI=1SC18H15N3O5Sc12618(25)10523813(10)27914(22)19127461115(12)17(24)212016(11)23h28H9H21H3(H1922)(H2023)(H2124)
methyl2((2((14dioxo1234tetrahydrophthalazin5yl)amino)2oxoethyl)sulfanyl)benzoate
METHYL2(2((14DIOXO23DIHYDROPHTHALAZIN5YL)AMINO)2OXOETHYL)SULFANYLBENZOATE
MFCD06016512
ZINC000004625532
ZINC04625532
ZINC4625532
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