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'-cyclopentan]-2-yl]sulfanyl}acetamide
Catalog ID
STK552764
SMILES O=C(Nc1cccc(c1)C)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 C29H31N3O2S MW 485.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O2S/c1-19(2)17-32-27(34)25-26(23-12-5-4-10-21(23)16-29(25)13-6-7-14-29)31-28(32)35-18-24(33)30-22-11-8-9-20(3)15-22/h4-5,8-12,15H,1,6-7,13-14,16-18H2,2-3H3,(H,30,33)InChIKey
PMMJDWXDKKTUNA-UHFFFAOYSA-NSynonyms
835909-54-12((3(2methylallyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)N(mtolyl)acetamide
835909541
CC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC(=C)C)C4(CCCC4)CC5=CC=CC=C53
InChI=1SC29H31N3O2Sc119(2)173227(34)2526(2312541021(23)1629(25)13671429)3128(32)351824(33)3022118920(3)1522h4581215H16713141618H223H3(H3033)
MFCD03687009
N(3methylphenyl)2((3(2methylprop2en1yl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)acetamide
N(3METHYLPHENYL)2(3(2METHYLPROP2ENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLACETAMIDE
ZINC000002249302
ZINC02249302
ZINC2249302
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