Vitas-M small molecule compound
2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Catalog ID
STK551747
SMILES C=CCn1c(SCC(=O)NCCc2ccccc2)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/c1-2-18-32-27(34)25-26(23-13-7-6-12-22(23)19-29(25)15-8-9-16-29)31-28(32)35-20-24(33)30-17-14-21-10-4-3-5-11-21/h2-7,10-13H,1,8-9,14-20H2,(H,30,33)InChIKey
VXLAUCDZUCPUMB-UHFFFAOYSA-NSynonyms
799835-71-52((3allyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)Nphenethylacetamide
2((4oxo3(prop2en1yl)46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)N(2phenylethyl)acetamide
2(4oxo3prop2enylspiro(6Hbenzo(h)quinazoline51cyclopentane)2yl)sulfanylN(2phenylethyl)acetamide
2(4OXO3PROP2ENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLNPHENETHYLACETAMIDE
799835715
C=CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)NCCC5=CC=CC=C5
InChI=1SC29H31N3O2Sc12183227(34)2526(2313761222(23)1929(25)15891629)3128(32)352024(33)30171421104351121h271013H1891420H2(H3033)
MFCD03685143
ZINC000002246771
ZINC02246771
ZINC2246771
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