Vitas-M small molecule compound
3-benzyl-2-[(2-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK551931
SMILES Cc1ccccc1CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)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 C32H32N2OS MW 492.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N2OS/c1-23-12-6-7-16-26(23)22-36-31-33-29-27-17-9-8-15-25(27)20-32(18-10-3-11-19-32)28(29)30(35)34(31)21-24-13-4-2-5-14-24/h2,4-9,12-17H,3,10-11,18-22H2,1H3InChIKey
QTEQWYJBSWYOQF-UHFFFAOYSA-NSynonyms
799781-49-03benzyl2((2methylbenzyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3benzyl2((2methylbenzyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3BENZYL2((2METHYLPHENYL)METHYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
799781490
CC1=CC=CC=C1CSC2=NC3=C(C(=O)N2CC4=CC=CC=C4)C5(CCCCC5)CC6=CC=CC=C63
InChI=1SC32H32N2OSc12312671626(23)22363133292717981525(27)2032(18103111932)28(29)30(35)34(31)2124134251424h2491217H310111822H21H3
MFCD03674255
ZINC000002212280
ZINC02212280
ZINC2212280
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