Vitas-M small molecule compound

2-(sulfanylmethyl)-6H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4-ol

Catalog ID
STK623464
SMILES SCc1nc(O)c2c(n1)c1ccccc1CC12CCCCC1

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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 C18H20N2OS MW 312.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2OS/c21-17-15-16(19-14(11-22)20-17)13-7-3-2-6-12(13)10-18(15)8-4-1-5-9-18/h2-3,6-7,22H,1,4-5,8-11H2,(H,19,20,21)
InChIKey
MKNCFKFNBUWMQT-UHFFFAOYSA-N
Synonyms
330819-74-4
2(sulfanylmethyl)6Hspiro(benzo(h)quinazoline51cyclohexan)4ol
2(SULFANYLMETHYL)SPIRO(16DIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
330819744
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N=C(N4)CS
InChI=1SC18H20N2OSc21171516(1914(1122)2017)13732612(13)1018(15)8415918h236722H145811H2(H192021)
MFCD09795235
ZINC000009692058
ZINC00346286
ZINC09692058
ZINC9692058

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.