Vitas-M small molecule compound
3-(3-methylphenyl)-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK551592
SMILES CC(=C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)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 C27H28N2OS MW 428.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2OS/c1-18(2)17-31-26-28-24-22-12-5-4-10-20(22)16-27(13-6-7-14-27)23(24)25(30)29(26)21-11-8-9-19(3)15-21/h4-5,8-12,15H,1,6-7,13-14,16-17H2,2-3H3InChIKey
LDLLRVFVYKVZDF-UHFFFAOYSA-NSynonyms
835906-88-22((2methylallyl)thio)3(mtolyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(3methylphenyl)2((2methylprop2en1yl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(3METHYLPHENYL)2(2METHYLPROP2ENYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
835906882
CC1=CC(=CC=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCC5)N=C2SCC(=C)C
InChI=1SC27H28N2OSc118(2)17312628242212541020(22)1627(13671427)23(24)25(30)29(26)21118919(3)1521h4581215H16713141617H223H3
MFCD03686448
ZINC000002248001
ZINC02248001
ZINC2248001
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