Vitas-M small molecule compound

1-(3-hydroxypropyl)-2-(3-methoxyphenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione

Catalog ID
STK857168
SMILES OCCCn1c(nc(=S)c2c1CCCC2)c1cccc(c1)OC

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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 C18H22N2O2S MW 330.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O2S/c1-22-14-7-4-6-13(12-14)17-19-18(23)15-8-2-3-9-16(15)20(17)10-5-11-21/h4,6-7,12,21H,2-3,5,8-11H2,1H3
InChIKey
ATKNXCHQVTYOQC-UHFFFAOYSA-N
Synonyms
710985-81-2
1(3hydroxypropyl)2(3methoxyphenyl)5678tetrahydroquinazoline4(1H)thione
1(3hydroxypropyl)2(3methoxyphenyl)5678tetrahydroquinazoline4thione
710985812
COC1=CC=CC(=C1)C2=NC(=S)C3=C(N2CCCO)CCCC3
InChI=1SC18H22N2O2Sc1221474613(1214)171918(23)15823916(15)20(17)1051121h4671221H235811H21H3
MFCD05997026
ZINC000002865555
ZINC02865555
ZINC2865555

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Available files

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