Vitas-M small molecule compound

2-[(4-chlorobenzyl)sulfanyl]-3-(furan-2-ylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

Catalog ID
STK540665
SMILES Clc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)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 C29H27ClN2O2S MW 503.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN2O2S/c30-22-12-10-20(11-13-22)19-35-28-31-26-24-9-3-2-7-21(24)17-29(14-4-1-5-15-29)25(26)27(33)32(28)18-23-8-6-16-34-23/h2-3,6-13,16H,1,4-5,14-15,17-19H2
InChIKey
KSGQYVLAMRGJRZ-UHFFFAOYSA-N
Synonyms
371206-25-6
2((4chlorobenzyl)sulfanyl)3(furan2ylmethyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((4chlorobenzyl)thio)3(furan2ylmethyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((4CHLOROPHENYL)METHYLSULFANYL)3(FURAN2YLMETHYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
371206256
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC5=CC=C(C=C5)Cl)CC6=CC=CO6
InChI=1SC29H27ClN2O2Sc3022121020(111322)193528312624932721(24)1729(144151529)25(26)27(33)32(28)182386163423h2361316H14514151719H2
MFCD03009610
ZINC000002315450
ZINC02315450
ZINC2315450

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Available files

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