Vitas-M small molecule compound
N-(4-methoxyphenyl)-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
STK552496
SMILES COc1ccc(cc1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3
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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 C29H31N3O3S MW 501.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O3S/c1-19(2)17-32-27(34)25-26(23-9-5-4-8-20(23)16-29(25)14-6-7-15-29)31-28(32)36-18-24(33)30-21-10-12-22(35-3)13-11-21/h4-5,8-13H,1,6-7,14-18H2,2-3H3,(H,30,33)InChIKey
CFOMBZLRQINSGN-UHFFFAOYSA-NSynonyms
840456-74-8840456748
CC(=C)CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)NC5=CC=C(C=C5)OC
InChI=1SC29H31N3O3Sc119(2)173227(34)2526(23954820(23)1629(25)14671529)3128(32)361824(33)3021101222(353)131121h45813H1671418H223H3(H3033)
MFCD03694230
N(4methoxyphenyl)2((3(2methylallyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)acetamide
N(4methoxyphenyl)2((3(2methylprop2en1yl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)acetamide
N(4METHOXYPHENYL)2(3(2METHYLPROP2ENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLACETAMIDE
ZINC000002256576
ZINC02256576
ZINC2256576
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