Vitas-M small molecule compound

1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile

Catalog ID
STK882457
SMILES N#Cc1cc2c(n(c1=O)c1nnc(s1)SCc1ccccc1)nc1n(c2=O)cccc1

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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 C21H12N6O2S2 MW 444.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12N6O2S2/c22-11-14-10-15-17(23-16-8-4-5-9-26(16)19(15)29)27(18(14)28)20-24-25-21(31-20)30-12-13-6-2-1-3-7-13/h1-10H,12H2
InChIKey
ZZHCWQJZRCAJPI-UHFFFAOYSA-N
Synonyms
881445-53-0
1(5(benzylsulfanyl)134thiadiazol2yl)25dioxo15dihydro2Hdipyrido(12a23d)pyrimidine3carbonitrile
1(5benzylsulfanyl134thiadiazol2yl)25dioxodipyrido(12d34f)pyrimidine3carbonitrile
881445530
C1=CC=C(C=C1)CSC2=NN=C(S2)N3C4=C(C=C(C3=O)C#N)C(=O)N5C=CC=CC5=N4
InChI=1SC21H12N6O2S2c221114101517(2316845926(16)19(15)29)27(18(14)28)20242521(3120)3012136213713h110H12H2
MFCD06651314
ZINC000008611549
ZINC8611549

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Available files

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