Vitas-M small molecule compound
N-[4-(acetylamino)phenyl]-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide
Catalog ID
STK550823
SMILES CC(=C)Cn1c(SCC(=O)Nc2ccc(cc2)NC(=O)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 C30H32N4O3S MW 528.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N4O3S/c1-19(2)17-34-28(37)26-27(24-9-5-4-8-21(24)16-30(26)14-6-7-15-30)33-29(34)38-18-25(36)32-23-12-10-22(11-13-23)31-20(3)35/h4-5,8-13H,1,6-7,14-18H2,2-3H3,(H,31,35)(H,32,36)InChIKey
GMVJIKKXEPQUAQ-UHFFFAOYSA-NSynonyms
839702-77-1839702771
CC(=C)CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)NC5=CC=C(C=C5)NC(=O)C
InChI=1SC30H32N4O3Sc119(2)173428(37)2627(24954821(24)1630(26)14671530)3329(34)381825(36)3223121022(111323)3120(3)35h45813H1671418H223H3(H3135)(H3236)
MFCD03693252
N(4(acetylamino)phenyl)2((3(2methylprop2en1yl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)acetamide
N(4acetamidophenyl)2((3(2methylallyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)acetamide
N(4ACETAMIDOPHENYL)2(3(2METHYLPROP2ENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLACETAMIDE
ZINC000002255309
ZINC02255309
ZINC2255309
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Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.