Vitas-M small molecule compound

2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(cyclopentylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

Catalog ID
STK832559
SMILES Clc1ccc(cc1)C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC1CCCC1)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 C31H33ClN2O2S MW 533.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33ClN2O2S/c32-24-14-12-22(13-15-24)26(35)20-37-30-33-28-25-11-5-4-10-23(25)18-31(16-6-1-7-17-31)27(28)29(36)34(30)19-21-8-2-3-9-21/h4-5,10-15,21H,1-3,6-9,16-20H2
InChIKey
FUIADPODHFZLOZ-UHFFFAOYSA-N
Synonyms
327167-36-2
2((2(4chlorophenyl)2oxoethyl)sulfanyl)3(cyclopentylmethyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((2(4CHLOROPHENYL)2OXOETHYL)SULFANYL)3(CYCLOPENTYLMETHYL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXANE)4(3H)ONE
2((2(4chlorophenyl)2oxoethyl)thio)3(cyclopentylmethyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(2(4CHLOROPHENYL)2OXOETHYL)SULFANYL3(CYCLOPENTYLMETHYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
2(4CHLOROPHENACYLTHIO)3(CYCLOPENTYLMETHYL)SPIRO(BENZO(H)QUINAZOLINE5(6H)1CYCLOHEXANE)4(3H)ONE
327167362
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC(=O)C5=CC=C(C=C5)Cl)CC6CCCC6
InChI=1SC31H33ClN2O2Sc3224141222(131524)26(35)20373033282511541023(25)1831(166171731)27(28)29(36)34(30)1921823921h45101521H13691620H2
MFCD01174990
ZINC000002115831
ZINC02115831
ZINC2115831

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Available files

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