CHEBI:109128 - 2-[2-[[2-[[1-(4-methoxyphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]-1-oxoethyl]amino]-4-thiazolyl]acetic acid ethyl ester

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ChEBI Name 2-[2-[[2-[[1-(4-methoxyphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]-1-oxoethyl]amino]-4-thiazolyl]acetic acid ethyl ester
ChEBI ID CHEBI:109128
Stars This entity has been manually annotated by a third party.
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Formula C21H20N6O4S2
Net Charge 0
Average Mass 484.554
Monoisotopic Mass 484.09875
InChI InChI=1S/C21H20N6O4S2/c1-3-31-18(29)8-13-10-33-21(25-13)26-17(28)11-32-20-16-9-24-27(19(16)22-12-23-20)14-4-6-15(30-2)7-5-14/h4-7,9-10,12H,3,8,11H2,1-2H3,(H,25,26,28)
InChIKey HGIOHVCLLQYRJR-UHFFFAOYSA-N
SMILES CCOC(=O)CC1=CSC(=N1)NC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)OC
ChEBI Ontology
Outgoing 2-[2-[[2-[[1-(4-methoxyphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]-1-oxoethyl]amino]-4-thiazolyl]acetic acid ethyl ester (CHEBI:109128) is a pyrazoles (CHEBI:26410)
2-[2-[[2-[[1-(4-methoxyphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]thio]-1-oxoethyl]amino]-4-thiazolyl]acetic acid ethyl ester (CHEBI:109128) is a ring assembly (CHEBI:36820)
Manual Xref Database
LSM-20526 LINCS
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