Vitas-M small molecule compound

N-(3-chloro-4-methoxyphenyl)-2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide

Catalog ID
STL190299
SMILES COc1ccc(cc1Cl)NC(=O)CSc1ncnc2c1[nH]c1c2cc(cc1)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 C20H17ClN4O2S MW 412.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN4O2S/c1-11-3-5-15-13(7-11)18-19(25-15)20(23-10-22-18)28-9-17(26)24-12-4-6-16(27-2)14(21)8-12/h3-8,10,25H,9H2,1-2H3,(H,24,26)
InChIKey
SIXZUIZFYHPNNM-UHFFFAOYSA-N
Synonyms

CC1=CC2=C(C=C1)NC3=C2N=CN=C3SCC(=O)NC4=CC(=C(C=C4)OC)Cl
COc1ccc(cc1Cl)NC(=O)CSc1ncnc2c1(nH)c1c2cc(cc1)C
InChI=1SC20H17ClN4O2Sc111351513(711)1819(2515)20(23102218)28917(26)24124616(272)14(21)812h381025H9H212H3(H2426)
MFCD15140108
N(3chloro4methoxyphenyl)2((8methyl5Hpyrimido(54b)indol4yl)sulfanyl)acetamide
ZINC000033172485
ZINC33172485

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Available files

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