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N-benzyl-4-(4-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
SpectraBase Compound ID ILNxd55y8J1
InChI InChI=1S/C20H21N3O2S/c1-13-17(19(24)21-12-14-6-4-3-5-7-14)18(23-20(26)22-13)15-8-10-16(25-2)11-9-15/h3-11,18H,12H2,1-2H3,(H,21,24)(H2,22,23,26)
InChIKey BTWOYGZLZZRHNT-UHFFFAOYSA-N
Mol Weight 367.47 g/mol
Molecular Formula C20H21N3O2S
Exact Mass 367.135448 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 19DcCo0YDQG
Name N-benzyl-4-(4-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
Alternate Name(s) N-benzyl-4-(4-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide 4-(4-Methoxyphenyl)-6-methyl-N-(phenylmethyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21N3O2S
InChI InChI=1S/C20H21N3O2S/c1-13-17(19(24)21-12-14-6-4-3-5-7-14)18(23-20(26)22-13)15-8-10-16(25-2)11-9-15/h3-11,18H,12H2,1-2H3,(H,21,24)(H2,22,23,26)
InChIKey BTWOYGZLZZRHNT-UHFFFAOYSA-N
Molecular Weight 367.467 g/mol
SMILES N1C(NC(C(C(NCc2ccccc2)=O)=C1C)c1ccc(cc1)OC)=S
SPLASH splash10-000x-9882000000-db30d2aafeabaf54de7d
Source of Spectrum IY-3-136-0
Wiley ID 1718084