Vitas-M small molecule compound

N-(2,4-dimethylphenyl)-2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide

Catalog ID
STK552882
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2C)C)nc2c(c1=O)C1(CCCC1)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 C29H31N3O2S MW 485.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O2S/c1-4-15-32-27(34)25-26(22-10-6-5-9-21(22)17-29(25)13-7-8-14-29)31-28(32)35-18-24(33)30-23-12-11-19(2)16-20(23)3/h4-6,9-12,16H,1,7-8,13-15,17-18H2,2-3H3,(H,30,33)
InChIKey
DHJRWYCQKHFPJV-UHFFFAOYSA-N
Synonyms
840461-78-1
2((3allyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)N(24dimethylphenyl)acetamide
840461781
CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC=C)C4(CCCC4)CC5=CC=CC=C53)C
InChI=1SC29H31N3O2Sc14153227(34)2526(221065921(22)1729(25)13781429)3128(32)351824(33)3023121119(2)1620(23)3h4691216H17813151718H223H3(H3033)
MFCD03695390
N(24dimethylphenyl)2((4oxo3(prop2en1yl)46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)acetamide
N(24DIMETHYLPHENYL)2(4OXO3PROP2ENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLACETAMIDE
ZINC000002258181
ZINC02258181
ZINC2258181

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Available files

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