Vitas-M small molecule compound
2-[(3-methylbenzyl)sulfanyl]-3-phenyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK550432
SMILES Cc1cccc(c1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)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 C31H30N2OS MW 478.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N2OS/c1-22-11-10-12-23(19-22)21-35-30-32-28-26-16-7-6-13-24(26)20-31(17-8-3-9-18-31)27(28)29(34)33(30)25-14-4-2-5-15-25/h2,4-7,10-16,19H,3,8-9,17-18,20-21H2,1H3InChIKey
DCKFNETXMDALOL-UHFFFAOYSA-NSynonyms
799819-27-52((3methylbenzyl)sulfanyl)3phenyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((3methylbenzyl)thio)3phenyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((3METHYLPHENYL)METHYLSULFANYL)3PHENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
799819275
CC1=CC(=CC=C1)CSC2=NC3=C(C(=O)N2C4=CC=CC=C4)C5(CCCCC5)CC6=CC=CC=C63
InChI=1SC31H30N2OSc12211101223(1922)21353032282616761324(26)2031(178391831)27(28)29(34)33(30)25144251525h247101619H38917182021H21H3
MFCD03681787
ZINC000002234995
ZINC02234995
ZINC2234995
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