Vitas-M small molecule compound
N-(3-methylphenyl)-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Catalog ID
STK542106
SMILES O=C(Nc1cccc(c1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3
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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 C30H33N3O2S MW 499.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N3O2S/c1-20(2)18-33-28(35)26-27(24-13-6-5-11-22(24)17-30(26)14-7-4-8-15-30)32-29(33)36-19-25(34)31-23-12-9-10-21(3)16-23/h5-6,9-13,16H,1,4,7-8,14-15,17-19H2,2-3H3,(H,31,34)InChIKey
XBPQLADZRZOSQG-UHFFFAOYSA-NSynonyms
488841-94-72((3(2methylallyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(mtolyl)acetamide
488841947
CC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC(=C)C)C4(CCCCC4)CC5=CC=CC=C53
InChI=1SC30H33N3O2Sc120(2)183328(35)2627(2413651122(24)1730(26)147481530)3229(33)361925(34)31231291021(3)1623h5691316H147814151719H223H3(H3134)
MFCD03294358
N(3methylphenyl)2((3(2methylprop2en1yl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
N(3METHYLPHENYL)2(3(2METHYLPROP2ENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
ZINC000001835160
ZINC01835160
ZINC1835160
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