Vitas-M small molecule compound

4-amino-2-{[2-(1,2-dimethyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}pyrimidine-5-carbonitrile

Catalog ID
STK238705
SMILES N#Cc1cnc(nc1N)SCC(=O)c1c(C)n(c2c1cccc2)C

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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 C17H15N5OS MW 337.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N5OS/c1-10-15(12-5-3-4-6-13(12)22(10)2)14(23)9-24-17-20-8-11(7-18)16(19)21-17/h3-6,8H,9H2,1-2H3,(H2,19,20,21)
InChIKey
NYQCMJSPPFPHNI-UHFFFAOYSA-N
Synonyms

4amino2((2(12dimethyl1Hindol3yl)2oxoethyl)sulfanyl)pyrimidine5carbonitrile
4AMINO2(2(12DIMETHYLINDOL3YL)2OXOETHYL)SULFANYLPYRIMIDINE5CARBONITRILE
CC1=C(C2=CC=CC=C2N1C)C(=O)CSC3=NC=C(C(=N3)N)C#N
InChI=1SC17H15N5OSc11015(12534613(12)22(10)2)14(23)9241720811(718)16(19)2117h368H9H212H3(H2192021)
MFCD07791972
ZINC000004973760
ZINC04973760
ZINC4973760

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Available files

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