Vitas-M small molecule compound

1'H-spiro[cycloheptane-1,2'-quinazoline]-4'(3'H)-thione

Catalog ID
STL134431
SMILES S=C1NC2(CCCCCC2)Nc2c1cccc2

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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 C14H18N2S MW 246.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N2S/c17-13-11-7-3-4-8-12(11)15-14(16-13)9-5-1-2-6-10-14/h3-4,7-8,15H,1-2,5-6,9-10H2,(H,16,17)
InChIKey
UWQPLNLJLOVGIV-UHFFFAOYSA-N
Synonyms
892299-03-5
1Hspiro(cycloheptane12quinazoline)4(3H)thione
1HSPIRO(CYCLOHEPTANE12QUINAZOLINE)4THIOL
892299035
C1CCCC2(CC1)NC3=CC=CC=C3C(=S)N2
InChI=1SC14H18N2Sc171311734812(11)1514(1613)951261014h347815H1256910H2(H1617)
MFCD07655737
SPIRO(13DIHYDROQUINAZOLINE21CYCLOHEPTANE)4THIONE
ZINC000004372224
ZINC04372224
ZINC4372224

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Available files

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