Vitas-M small molecule compound

N-(4-oxo-2-sulfanyl-5,6,7,8,9,10-hexahydrocycloocta[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)-1-benzothiophene-3-carboxamide

Catalog ID
STK438638
SMILES Sc1nc2sc3c(c2c(=O)n1NC(=O)c1csc2c1cccc2)CCCCCC3

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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 C21H19N3O2S3 MW 441.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O2S3/c25-18(14-11-28-15-9-6-5-7-12(14)15)23-24-20(26)17-13-8-3-1-2-4-10-16(13)29-19(17)22-21(24)27/h5-7,9,11H,1-4,8,10H2,(H,22,27)(H,23,25)
InChIKey
ZOHKUSIAHOJEFM-UHFFFAOYSA-N
Synonyms

C1CCCC2=C(CC1)C3=C(S2)NC(=S)N(C3=O)NC(=O)C4=CSC5=CC=CC=C54
InChI=1SC21H19N3O2S3c2518(14112815965712(14)15)232420(26)1713831241016(13)2919(17)2221(24)27h57911H14810H2(H2227)(H2325)
MFCD03945515
N(4oxo2sulfanyl5678910hexahydrocycloocta(45)thieno(23d)pyrimidin3(4H)yl)1benzothiophene3carboxamide
N(4oxo2sulfanylidene5678910hexahydro1Hcycloocta(23)thieno(24b)pyrimidin3yl)1benzothiophene3carboxamide
ZINC000019634784
ZINC19634784

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Available files

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