methyl 5-azanyl-1-[4-[2-(furan-2-yl)ethylcarbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: methyl 5-azanyl-1-[4-[2-(furan-2-yl)ethylcarbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: methyl 5-amino-1-[4-[2-(2-furyl)ethylcarbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[4-[[2-(2-furanyl)ethylamino]-oxomethyl]phenyl]-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-1-[4-[2-(furan-2-yl)ethylcarbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[4-[2-(2-furyl)ethylcarbamoyl]phenyl]pyrazole-4-carboxylic acid methyl ester Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCCC3=CC=CO3)N

Isomeric SMILES

COC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NCCC3=CC=CO3)N

InChI

InChI=1S/C18H18N4O4/c1-25-18(24)15-11-21-22(16(15)19)13-6-4-12(5-7-13)17(23)20-9-8-14-3-2-10-26-14/h2-7,10-11H,8-9,19H2,1H3,(H,20,23)