Vitas-M small molecule compound

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

Catalog ID
STK023313
SMILES O=C(c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCCC1)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 C30H32N2O2S MW 484.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O2S/c33-25(21-11-3-1-4-12-21)20-35-29-31-27-24-16-8-5-13-22(24)19-30(17-9-2-10-18-30)26(27)28(34)32(29)23-14-6-7-15-23/h1,3-5,8,11-13,16,23H,2,6-7,9-10,14-15,17-20H2
InChIKey
IVAAAXKTWUFCLZ-UHFFFAOYSA-N
Synonyms
337495-96-2
337495962
3CYCLOPENTYL2((2OXO2PHENYLETHYL)SULFANYL)3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXAN)4(6H)ONE
3cyclopentyl2((2oxo2phenylethyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3CYCLOPENTYL2(2OXO2PHENYLETHYLTHIO)SPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
3CYCLOPENTYL2PHENACYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC(=O)C5=CC=CC=C5)C6CCCC6
InChI=1SC30H32N2O2Sc3325(21113141221)20352931272416851322(24)1930(1792101830)26(27)28(34)32(29)2314671523h135811131623H26791014151720H2
MFCD01559077
O=C(c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCCC1)CCCCC3
STK023313
ZINC000002254672
ZINC02254672
ZINC2254672

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Available files

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