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2-(dimethylamino)-5-(4-methoxyphenyl)-7-methyl-4-[4-(phenylmethyl)-1-piperazinyl]-5H-pyrano[2,3-d]pyrimidine-6-carboxylic acid ethyl ester

View entire compound with spectra: 1 MS (GC)

2-(dimethylamino)-5-(4-methoxyphenyl)-7-methyl-4-[4-(phenylmethyl)-1-piperazinyl]-5H-pyrano[2,3-d]pyrimidine-6-carboxylic acid ethyl ester
SpectraBase Compound ID AkJ6eoKFnWP
InChI InChI=1S/C31H37N5O4/c1-6-39-30(37)25-21(2)40-29-27(26(25)23-12-14-24(38-5)15-13-23)28(32-31(33-29)34(3)4)36-18-16-35(17-19-36)20-22-10-8-7-9-11-22/h7-15,26H,6,16-20H2,1-5H3
InChIKey YADTYKMDWNFTIC-UHFFFAOYSA-N
Mol Weight 543.7 g/mol
Molecular Formula C31H37N5O4
Exact Mass 543.284555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JlvIWw0qm9N
Name 2-(dimethylamino)-5-(4-methoxyphenyl)-7-methyl-4-[4-(phenylmethyl)-1-piperazinyl]-5H-pyrano[2,3-d]pyrimidine-6-carboxylic acid ethyl ester
Alternate Name(s) 4-(4-benzylpiperazino)-2-(dimethylamino)-5-(4-methoxyphenyl)-7-methyl-5H-pyrano[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Ethyl 2-(dimethylamino)-5-(4-methoxyphenyl)-7-methyl-4-[4-(phenylmethyl)piperazin-1-yl]-5H-pyrano[2,3-d]pyrimidine-6-carboxylate Ethyl 4-(4-benzylpiperazin-1-yl)-2-(dimethylamino)-5-(4-methoxyphenyl)-7-methyl-5H-pyrano[2,3-d]pyrimidine-6-carboxylate
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Formula C31H37N5O4
InChI InChI=1S/C31H37N5O4/c1-6-39-30(37)25-21(2)40-29-27(26(25)23-12-14-24(38-5)15-13-23)28(32-31(33-29)34(3)4)36-18-16-35(17-19-36)20-22-10-8-7-9-11-22/h7-15,26H,6,16-20H2,1-5H3
InChIKey YADTYKMDWNFTIC-UHFFFAOYSA-N
Molecular Weight 543.668 g/mol
SMILES c12c(nc(nc2OC(=C(C1c1ccc(cc1)OC)C(=O)OCC)C)N(C)C)N1CCN(CC1)Cc1ccccc1
SPLASH splash10-0f6t-0009620000-ce1962330e345e3639bc
Source of Spectrum F-51-5909-5
Wiley ID 792054