Vitas-M small molecule compound

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

Catalog ID
STK524481
SMILES Clc1ccc(cc1)C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCOC(C1)(C)C)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 C32H35ClN2O3S MW 563.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H35ClN2O3S/c1-31(2)19-24(14-17-38-31)35-29(37)27-28(34-30(35)39-20-26(36)21-10-12-23(33)13-11-21)25-9-5-4-8-22(25)18-32(27)15-6-3-7-16-32/h4-5,8-13,24H,3,6-7,14-20H2,1-2H3
InChIKey
CRNVWWNMABQICT-UHFFFAOYSA-N
Synonyms

2((2(4CHLOROPHENYL)2OXOETHYL)SULFANYL)3((4S)22DIMETHYLTETRAHYDRO2HPYRAN4YL)3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXAN)4(6H)ONE
2((2(4chlorophenyl)2oxoethyl)sulfanyl)3(22dimethyltetrahydro2Hpyran4yl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((2(4CHLOROPHENYL)2OXOETHYL)SULFANYL)3(22DIMETHYLTETRAHYDRO2HPYRAN4YL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXANE)4(3H)ONE
2((2(4chlorophenyl)2oxoethyl)thio)3(22dimethyltetrahydro2Hpyran4yl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(2(4CHLOROPHENYL)2OXOETHYL)SULFANYL3(22DIMETHYLOXAN4YL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CC1(CC(CCO1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)C6=CC=C(C=C6)Cl)C
InChI=1SC32H35ClN2O3Sc131(2)1924(14173831)3529(37)2728(3430(35)392026(36)21101223(33)131121)25954822(25)1832(27)156371632h4581324H3671420H212H3
ZINC000001869315
ZINC000001869316

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Available files

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