Vitas-M small molecule compound

3-benzyl-2-(ethylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

Catalog ID
STK831295
SMILES CCSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)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 C26H28N2OS MW 416.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2OS/c1-2-30-25-27-23-21-14-8-7-13-20(21)17-26(15-9-4-10-16-26)22(23)24(29)28(25)18-19-11-5-3-6-12-19/h3,5-8,11-14H,2,4,9-10,15-18H2,1H3
InChIKey
XTTOVWKHXAMCIZ-UHFFFAOYSA-N
Synonyms
172984-44-0
172984440
2(ETHYLTHIO)3(PHENYLMETHYL)SPIRO(BENZO(H)QUINAZOLINE5(3H)1CYCLOHEXAN)4(6H)ONE
2ETHYLTHIO3BENZYLSPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
3benzyl2(ethylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3BENZYL2(ETHYLSULFANYL)46DIHYDRO3HSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
3BENZYL2(ETHYLSULFANYL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXANE)4(3H)ONE
3benzyl2(ethylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3BENZYL2ETHYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CCSC1=NC2=C(C(=O)N1CC3=CC=CC=C3)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC26H28N2OSc12302527232114871320(21)1726(1594101626)22(23)24(29)28(25)1819115361219h3581114H249101518H21H3
MFCD00339000
SPIRO(BENZO(H)QUINAZOLINE5(3H)1CYCLOHEXAN)4(6H)ONE2(ETHYLTHIO)3(PHENYLMETHYL)
ZINC000002207977
ZINC02207977
ZINC2207977

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Available files

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