Vitas-M small molecule compound

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

Catalog ID
STK093295
SMILES Clc1ccc(cc1)C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC1CCCCC1)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 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(16-6-7-17-31)27(28)29(36)34(30)19-21-8-2-1-3-9-21/h4-5,10-15,21H,1-3,6-9,16-20H2
InChIKey
VNSQUGRUINKNPD-UHFFFAOYSA-N
Synonyms
332145-38-7
2((2(4CHLOROPHENYL)2OXOETHYL)SULFANYL)3(CYCLOHEXYLMETHYL)3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTAN)4(6H)ONE
2((2(4CHLOROPHENYL)2OXOETHYL)SULFANYL)3(CYCLOHEXYLMETHYL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOPENTANE)4(3H)ONE
2((2(4chlorophenyl)2oxoethyl)thio)3(cyclohexylmethyl)3Hspiro(benzo(h)quinazoline51cyclopentan)4(6H)one
2(2(4CHLOROPHENYL)2OXOETHYL)SULFANYL3(CYCLOHEXYLMETHYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)4ONE
332145387
C1CCC(CC1)CN2C(=O)C3=C(C4=CC=CC=C4CC35CCCC5)N=C2SCC(=O)C6=CC=C(C=C6)Cl
Clc1ccc(cc1)C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC1CCCCC1)CCCC3
InChI=1SC31H33ClN2O2Sc3224141222(131524)26(35)20373033282511541023(25)1831(16671731)27(28)29(36)34(30)19218213921h45101521H13691620H2
MFCD01557036
STK093295
ZINC000002183053
ZINC02183053
ZINC2183053

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Available files

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