Vitas-M small molecule compound
2-[(4-methylbenzyl)sulfanyl]-3-(4-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Catalog ID
STK546573
SMILES Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCC3
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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/c1-21-9-13-23(14-10-21)20-35-30-32-28-26-8-4-3-7-24(26)19-31(17-5-6-18-31)27(28)29(34)33(30)25-15-11-22(2)12-16-25/h3-4,7-16H,5-6,17-20H2,1-2H3InChIKey
ZYABRFHHHIIITD-UHFFFAOYSA-NSynonyms
500144-49-02((4methylbenzyl)sulfanyl)3(4methylphenyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2((4methylbenzyl)thio)3(ptolyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(4METHYLPHENYL)2((4METHYLPHENYL)METHYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
500144490
CC1=CC=C(C=C1)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)C)C5(CCCC5)CC6=CC=CC=C63
InChI=1SC31H30N2OSc12191323(141021)203530322826843724(26)1931(17561831)27(28)29(34)33(30)25151122(2)121625h34716H561720H212H3
MFCD03304439
ZINC000002358673
ZINC02358673
ZINC2358673
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