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Vitas-M small molecule compound

3-(cyclohexylmethyl)-2-[(2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one

Catalog ID
STK075870
SMILES O=c1n(CC2CCCCC2)c(SCCc2ccccc2)nc2c1C1(CCCC1)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 C31H36N2OS MW 484.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N2OS/c34-29-27-28(26-16-8-7-15-25(26)21-31(27)18-9-10-19-31)32-30(33(29)22-24-13-5-2-6-14-24)35-20-17-23-11-3-1-4-12-23/h1,3-4,7-8,11-12,15-16,24H,2,5-6,9-10,13-14,17-22H2
InChIKey
AADHIXIJOLQJHJ-UHFFFAOYSA-N
Synonyms
332145-37-6
3(CYCLOHEXYLMETHYL)2((2PHENYLETHYL)SULFANYL)3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTAN)4(6H)ONE
3(CYCLOHEXYLMETHYL)2((2PHENYLETHYL)SULFANYL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTANE)4(3H)ONE
3(cyclohexylmethyl)2(2phenylethylsulfanyl)spiro(6Hbenzo(h)quinazoline51cyclopentane)4one
3(CYCLOHEXYLMETHYL)2(2PHENYLETHYLTHIO)SPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
3(cyclohexylmethyl)2(phenethylthio)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
3(CYCLOHEXYLMETHYL)2PHENETHYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
332145376
C1CCC(CC1)CN2C(=O)C3=C(C4=CC=CC=C4CC35CCCC5)N=C2SCCC6=CC=CC=C6
InChI=1SC31H36N2OSc34292728(2616871525(26)2131(27)189101931)3230(33(29)2224135261424)35201723113141223h134781112151624H25691013141722H2
MFCD01556779
O=c1n(CC2CCCCC2)c(SCCc2ccccc2)nc2c1C1(CCCC1)Cc1c2cccc1
STK075870
ZINC000002183052
ZINC02183052
ZINC2183052

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Available files

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