Vitas-M small molecule compound
N-(4-methylphenyl)-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
STK552252
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)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 C28H29N3O2S MW 471.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O2S/c1-3-16-31-26(33)24-25(22-9-5-4-8-20(22)17-28(24)14-6-7-15-28)30-27(31)34-18-23(32)29-21-12-10-19(2)11-13-21/h3-5,8-13H,1,6-7,14-18H2,2H3,(H,29,32)InChIKey
DOVPQCNHROWOAU-UHFFFAOYSA-NSynonyms
799791-37-02((3allyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)N(ptolyl)acetamide
799791370
CC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC=C)C4(CCCC4)CC5=CC=CC=C53
InChI=1SC28H29N3O2Sc13163126(33)2425(22954820(22)1728(24)14671528)3027(31)341823(32)2921121019(2)111321h35813H1671418H22H3(H2932)
MFCD03676289
N(4methylphenyl)2((4oxo3(prop2en1yl)46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)acetamide
N(4METHYLPHENYL)2(4OXO3PROP2ENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLACETAMIDE
ZINC000002215739
ZINC02215739
ZINC2215739
Check stock
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Check stock on Vitas-MAvailable files
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