Vitas-M small molecule compound
3-(2-methylphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK531366
SMILES O=C(c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)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 C32H30N2O2S MW 506.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N2O2S/c1-22-12-6-9-17-26(22)34-30(36)28-29(33-31(34)37-21-27(35)23-13-4-2-5-14-23)25-16-8-7-15-24(25)20-32(28)18-10-3-11-19-32/h2,4-9,12-17H,3,10-11,18-21H2,1H3InChIKey
MKNVFVCKANBTLC-UHFFFAOYSA-NSynonyms
2((2oxo2phenylethyl)thio)3(otolyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2methylphenyl)2((2oxo2phenylethyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2METHYLPHENYL)2PHENACYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CC1=CC=CC=C1N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)C6=CC=CC=C6
InChI=1SC32H30N2O2Sc12212691726(22)3430(36)2829(3331(34)372127(35)23134251423)2516871524(25)2032(28)18103111932h2491217H310111821H21H3
MFCD02234688
ZINC000002292868
ZINC02292868
ZINC2292868
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