Vitas-M small molecule compound
3-(4-methylphenyl)-2-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK555700
SMILES Cc1ccc(cc1)n1c(SCC(=O)c2cccs2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
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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 C30H28N2O2S2 MW 512.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N2O2S2/c1-20-11-13-22(14-12-20)32-28(34)26-27(31-29(32)36-19-24(33)25-10-7-17-35-25)23-9-4-3-8-21(23)18-30(26)15-5-2-6-16-30/h3-4,7-14,17H,2,5-6,15-16,18-19H2,1H3InChIKey
XKCGMLQPHBITSD-UHFFFAOYSA-NSynonyms
842974-90-72((2oxo2(thiophen2yl)ethyl)thio)3(ptolyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(4methylphenyl)2((2oxo2(thiophen2yl)ethyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(4METHYLPHENYL)2(2OXO2THIOPHEN2YLETHYL)SULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
842974907
CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)C6=CC=CS6
InChI=1SC30H28N2O2S2c120111322(141220)3228(34)2627(3129(32)361924(33)25107173525)23943821(23)1830(26)155261630h3471417H25615161819H21H3
MFCD04012938
ZINC000002409430
ZINC02409430
ZINC2409430
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