2-N,N-Di-n-hexylamino-3-phenyl-5,6,7,8-tetrahydrobenzothieno[2,3-d]pyrimidin-4(3H)-one

SpectraBase Compound ID	Ky4a52wxKQd
InChI	InChI=1S/C28H39N3OS/c1-3-5-7-14-20-30(21-15-8-6-4-2)28-29-26-25(23-18-12-13-19-24(23)33-26)27(32)31(28)22-16-10-9-11-17-22/h9-11,16-17H,3-8,12-15,18-21H2,1-2H3
InChIKey	QEWVUFJHBKGVCJ-UHFFFAOYSA-N Google Search
Mol Weight	465.7 g/mol
Molecular Formula	C28H39N3OS
Exact Mass	465.281384 g/mol

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SpectraBase Spectrum ID	990dmecHxbz
Name	2-N,N-di-N-Hexylamino-3-phenyl-5,6,7,8-tetrahydrobenzothieno[2,3-D]pyrimidin-4(3H)-one
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	465.281384061 u
Formula	C28H39N3OS
InChI	InChI=1S/C28H39N3OS/c1-3-5-7-14-20-30(21-15-8-6-4-2)28-29-26-25(23-18-12-13-19-24(23)33-26)27(32)31(28)22-16-10-9-11-17-22/h9-11,16-17H,3-8,12-15,18-21H2,1-2H3
InChIKey	QEWVUFJHBKGVCJ-UHFFFAOYSA-N
Molecular Weight	465.700 g/mol
SMILES	C1(=NC=2SC=3CCCCC3C2C(N1C1=CC=CC=C1)=O)N(CCCCCC)CCCCCC