Vitas-M small molecule compound

1-benzyl-N-(1,1-dioxidotetrahydrothiophen-3-yl)-9-methyl-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide

Catalog ID
STK583144
SMILES O=C(c1cc2c(n1Cc1ccccc1)nc1n(c2=O)cccc1C)NC1CCS(=O)(=O)C1

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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 C23H22N4O4S MW 450.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O4S/c1-15-6-5-10-26-20(15)25-21-18(23(26)29)12-19(27(21)13-16-7-3-2-4-8-16)22(28)24-17-9-11-32(30,31)14-17/h2-8,10,12,17H,9,11,13-14H2,1H3,(H,24,28)
InChIKey
SMJFATHWYIMTLL-UHFFFAOYSA-N
Synonyms
881292-77-9
1benzylN(11dioxidotetrahydrothiophen3yl)9methyl4oxo14dihydropyrido(12a)pyrrolo(23d)pyrimidine2carboxamide
881292779
CC1=CC=CN2C1=NC3=C(C2=O)C=C(N3CC4=CC=CC=C4)C(=O)NC5CCS(=O)(=O)C5
InChI=1SC23H22N4O4Sc11565102620(15)252118(23(26)29)1219(27(21)13167324816)22(28)241791132(3031)1417h28101217H9111314H21H3(H2428)
MFCD06773235
ZINC000009003983
ZINC000009003984

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Available files

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