Vitas-M small molecule compound

N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-chloro-2-(methylsulfanyl)pyrimidine-4-carboxamide

Catalog ID
STK882240
SMILES CSc1ncc(c(n1)C(=O)Nc1sc2c(c1C(=O)N)CCCC2)Cl

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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 C15H15ClN4O2S2 MW 382.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15ClN4O2S2/c1-23-15-18-6-8(16)11(19-15)13(22)20-14-10(12(17)21)7-4-2-3-5-9(7)24-14/h6H,2-5H2,1H3,(H2,17,21)(H,20,22)
InChIKey
WUUOUBQJMZVUPT-UHFFFAOYSA-N
Synonyms

CSC1=NC=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N)Cl
InChI=1SC15H15ClN4O2S2c123151868(16)11(1915)13(22)201410(12(17)21)742359(7)2414h6H25H21H3(H21721)(H2022)
MFCD06630979
N(3carbamoyl4567tetrahydro1benzothiophen2yl)5chloro2(methylsulfanyl)pyrimidine4carboxamide
N(3carbamoyl4567tetrahydro1benzothiophen2yl)5chloro2methylsulfanylpyrimidine4carboxamide
ZINC000004820280
ZINC04820280
ZINC4820280

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.