Vitas-M small molecule compound
3-(furan-2-ylmethyl)-2-[(4-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK540805
SMILES Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)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 C30H30N2O2S MW 482.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N2O2S/c1-21-11-13-22(14-12-21)20-35-29-31-27-25-10-4-3-8-23(25)18-30(15-5-2-6-16-30)26(27)28(33)32(29)19-24-9-7-17-34-24/h3-4,7-14,17H,2,5-6,15-16,18-20H2,1H3InChIKey
XPTYAKMUAHJCNX-UHFFFAOYSA-NSynonyms
371138-21-53(furan2ylmethyl)2((4methylbenzyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(furan2ylmethyl)2((4methylbenzyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(FURAN2YLMETHYL)2((4METHYLPHENYL)METHYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
371138215
CC1=CC=C(C=C1)CSC2=NC3=C(C(=O)N2CC4=CC=CO4)C5(CCCCC5)CC6=CC=CC=C63
InChI=1SC30H30N2O2Sc121111322(141221)2035293127251043823(25)1830(155261630)26(27)28(33)32(29)192497173424h3471417H25615161820H21H3
MFCD03008805
ZINC000001825965
ZINC01825965
ZINC1825965
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