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1-Allyl-3-benzoyl-1,2,3,4,5,6,7,8-octahydro[1]benzothieno[2,3-d]pyrimidine
SpectraBase Compound ID A5FSLP54atk
InChI InChI=1S/C20H22N2OS/c1-2-12-21-14-22(19(23)15-8-4-3-5-9-15)13-17-16-10-6-7-11-18(16)24-20(17)21/h2-5,8-9H,1,6-7,10-14H2
InChIKey YYSJPFOREKRGHH-UHFFFAOYSA-N
Mol Weight 338.47 g/mol
Molecular Formula C20H22N2OS
Exact Mass 338.145285 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ATkLoW72JfA
Name 1-Allyl-3-benzoyl-1,2,3,4,5,6,7,8-octahydro[1]benzothieno[2,3-d]pyrimidine
Alternate Name(s) (1-allyl-2,4,5,6,7,8-hexahydrobenzothiopheno[2,3-d]pyrimidin-3-yl)-phenyl-methanone phenyl-(1-prop-2-enyl-2,4,5,6,7,8-hexahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)methanone Pyrimido[4,5-b]benzothiiophene, 1,2,3,4,5,6,7,8-octahydro-1-allyl-3-benzoyl-
CAS Registry Number 339587-49-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2OS
InChI InChI=1S/C20H22N2OS/c1-2-12-21-14-22(19(23)15-8-4-3-5-9-15)13-17-16-10-6-7-11-18(16)24-20(17)21/h2-5,8-9H,1,6-7,10-14H2
InChIKey YYSJPFOREKRGHH-UHFFFAOYSA-N
Molecular Weight 338.469 g/mol
SMILES c12c(N(CC=C)CN(C2)C(=O)c2ccccc2)sc2c1CCCC2
SPLASH splash10-0a6r-9400000000-acf4b9a315ccf3267d6b
Source of Spectrum AD-0-2532-0
Wiley ID 1421405