6-amino-5-cyano-2-[[(3-cyano-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)thio]methyl]-4-(4-fluorophenyl)-4H-pyran-3-carboxylic acid methyl ester (CHEBI:121985)

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CHEBI:121985 - 6-amino-5-cyano-2-[[(3-cyano-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)thio]methyl]-4-(4-fluorophenyl)-4H-pyran-3-carboxylic acid methyl ester

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ChEBI ID	CHEBI:121985
ChEBI Name	6-amino-5-cyano-2-[[(3-cyano-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)thio]methyl]-4-(4-fluorophenyl)-4H-pyran-3-carboxylic acid methyl ester
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Formula	C25H22FN5O3S
Net Charge	0
Average Mass	491.548
Monoisotopic Mass	491.14274
SMILES	COC(=O)C1=C(CSc2nc3c(cc2C#N)CN(C)CC3)OC(N)=C(C#N)C1c1ccc(F)cc1
InChI	InChI=1S/C25H22FN5O3S/c1-31-8-7-19-16(12-31)9-15(10-27)24(30-19)35-13-20-22(25(32)33-2)21(18(11-28)23(29)34-20)14-3-5-17(26)6-4-14/h3-6,9,21H,7-8,12-13,29H2,1-2H3
InChIKey	MADHSJGAYLGOTF-UHFFFAOYSA-N

ChEBI Ontology

Outgoing Relation(s)
	6-amino-5-cyano-2-[[(3-cyano-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)thio]methyl]-4-(4-fluorophenyl)-4H-pyran-3-carboxylic acid methyl ester (CHEBI:121985) is a naphthyridine derivative (CHEBI:73539)

Manual Xrefs	Databases
LSM-33428	LINCS