Vitas-M small molecule compound

N-(3-chlorophenyl)-2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide

Catalog ID
STK558303
SMILES CCCn1c(SCC(=O)Nc2cccc(c2)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

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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 C28H30ClN3O2S MW 508.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30ClN3O2S/c1-2-15-32-26(34)24-25(22-12-5-4-9-19(22)17-28(24)13-6-3-7-14-28)31-27(32)35-18-23(33)30-21-11-8-10-20(29)16-21/h4-5,8-12,16H,2-3,6-7,13-15,17-18H2,1H3,(H,30,33)
InChIKey
LNKNWHRNLHVWCY-UHFFFAOYSA-N
Synonyms
586997-68-4
586997684
CCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)NC5=CC(=CC=C5)Cl
InChI=1SC28H30ClN3O2Sc12153226(34)2425(221254919(22)1728(24)136371428)3127(32)351823(33)30211181020(29)1621h4581216H236713151718H21H3(H3033)
MFCD04031293
N(3chlorophenyl)2((4oxo3propyl46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
N(3chlorophenyl)2((4oxo3propyl46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
N(3CHLOROPHENYL)2(4OXO3PROPYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
ZINC000002394278
ZINC02394278
ZINC2394278

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Available files

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