Vitas-M small molecule compound

N-butyl-2-[(7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide

Catalog ID
STL144318
SMILES CCCCNC(=O)CSc1ncnc2c1[nH]cc2c1ccccc1

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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 C18H20N4OS MW 340.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4OS/c1-2-3-9-19-15(23)11-24-18-17-16(21-12-22-18)14(10-20-17)13-7-5-4-6-8-13/h4-8,10,12,20H,2-3,9,11H2,1H3,(H,19,23)
InChIKey
SVDYDBUHUCINQW-UHFFFAOYSA-N
Synonyms

CCCCNC(=O)CSC1=NC=NC2=C1NC=C2C3=CC=CC=C3
CCCCNC(=O)CSc1ncnc2c1(nH)cc2c1ccccc1
InChI=1SC18H20N4OSc12391915(23)1124181716(21122218)14(102017)137546813h48101220H23911H21H3(H1923)
MFCD20750588
Nbutyl2((7phenyl5Hpyrrolo(32d)pyrimidin4yl)sulfanyl)acetamide
NBUTYL2((7PHENYL5HPYRROLO(32D)PYRIMIDIN4YL)THIO)ACETAMIDE
ZINC000071328128
ZINC71328128

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Available files

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