Vitas-M small molecule compound
2-[(2,4-dimethylbenzyl)sulfanyl]-3-(2-phenylethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK698954
SMILES Cc1ccc(c(c1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)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 C34H36N2OS MW 520.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H36N2OS/c1-24-15-16-28(25(2)21-24)23-38-33-35-31-29-14-8-7-13-27(29)22-34(18-9-4-10-19-34)30(31)32(37)36(33)20-17-26-11-5-3-6-12-26/h3,5-8,11-16,21H,4,9-10,17-20,22-23H2,1-2H3InChIKey
AWJPMCFHGSDUDG-UHFFFAOYSA-NSynonyms
2((24dimethylbenzyl)sulfanyl)3(2phenylethyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((24dimethylbenzyl)thio)3phenethyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((24dimethylphenyl)methylsulfanyl)3(2phenylethyl)spiro(6Hbenzo(h)quinazoline51cyclohexane)4one
2((24DIMETHYLPHENYL)METHYLSULFANYL)3PHENETHYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CC1=CC(=C(C=C1)CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)C5(CCCCC5)CC6=CC=CC=C63)C
InChI=1SC34H36N2OSc124151628(25(2)2124)23383335312914871327(29)2234(1894101934)30(31)32(37)36(33)201726115361226h358111621H491017202223H212H3
MFCD01807195
ZINC000001867683
ZINC01867683
ZINC1867683
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