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'-cyclohexan]-2-yl]sulfanyl}acetamide
Catalog ID
STK539060
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)C)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 C29H31N3O2S MW 485.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O2S/c1-3-17-32-27(34)25-26(23-10-6-5-9-21(23)18-29(25)15-7-4-8-16-29)31-28(32)35-19-24(33)30-22-13-11-20(2)12-14-22/h3,5-6,9-14H,1,4,7-8,15-19H2,2H3,(H,30,33)InChIKey
SUFKUROMNGTZPW-UHFFFAOYSA-NSynonyms
384368-72-32((3allyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(ptolyl)acetamide
384368723
CC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC=C)C4(CCCCC4)CC5=CC=CC=C53
InChI=1SC29H31N3O2Sc13173227(34)2526(231065921(23)1829(25)157481629)3128(32)351924(33)3022131120(2)121422h356914H14781519H22H3(H3033)
MFCD03284757
N(4methylphenyl)2((4oxo3(prop2en1yl)46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
N(4METHYLPHENYL)2(4OXO3PROP2ENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
ZINC000001814043
ZINC01814043
ZINC1814043
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