Vitas-M small molecule compound
3-benzyl-2-[(4-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK539422
SMILES Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(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/c1-23-14-16-25(17-15-23)22-36-31-33-29-27-13-7-6-12-26(27)20-32(18-8-3-9-19-32)28(29)30(35)34(31)21-24-10-4-2-5-11-24/h2,4-7,10-17H,3,8-9,18-22H2,1H3InChIKey
IIEPWLXQLUUOJN-UHFFFAOYSA-NSynonyms
371133-31-2371133312
3benzyl2((4methylbenzyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3benzyl2((4methylbenzyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3BENZYL2((4METHYLPHENYL)METHYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CC1=CC=C(C=C1)CSC2=NC3=C(C(=O)N2CC4=CC=CC=C4)C5(CCCCC5)CC6=CC=CC=C63
InChI=1SC32H32N2OSc123141625(171523)22363133292713761226(27)2032(188391932)28(29)30(35)34(31)2124104251124h2471017H3891822H21H3
MFCD03008529
ZINC000001902428
ZINC01902428
ZINC1902428
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