2-[3-(3-azanyl-4-oxidanylidene-1H-pyrazolo[4,3-c]quinolin-2-yl)-2-methyl-phenoxy]-N-methylsulfonyl-ethanamide

Systemtic Name: 2-[3-(3-azanyl-4-oxidanylidene-1H-pyrazolo[4,3-c]quinolin-2-yl)-2-methyl-phenoxy]-N-methylsulfonyl-ethanamide Openeye Name: 2-[3-(3-amino-4-oxo-1H-pyrazolo[4,3-c]quinolin-2-yl)-2-methyl-phenoxy]-N-methylsulfonyl-acetamide CAS Name: 2-[3-(3-amino-4-oxo-1H-pyrazolo[4,3-c]quinolin-2-yl)-2-methylphenoxy]-N-methylsulfonylacetamide IUPAC Name: 2-[3-(3-amino-4-oxo-1H-pyrazolo[4,3-c]quinolin-2-yl)-2-methylphenoxy]-N-methylsulfonylacetamide Traditional Name: 2-[3-(3-amino-4-keto-1H-pyrazolo[4,3-c]quinolin-2-yl)-2-methyl-phenoxy]-N-mesyl-acetamide Formula: C20H19N5O5S MolecularWeight: 441.46036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1OCC(=O)NS(=O)(=O)C)N2C(=C3C(=C4C=CC=CC4=NC3=O)N2)N

Isomeric SMILES

CC1=C(C=CC=C1OCC(=O)NS(=O)(=O)C)N2C(=C3C(=C4C=CC=CC4=NC3=O)N2)N

InChI

InChI=1S/C20H19N5O5S/c1-11-14(8-5-9-15(11)30-10-16(26)24-31(2,28)29)25-19(21)17-18(23-25)12-6-3-4-7-13(12)22-20(17)27/h3-9,23H,10,21H2,1-2H3,(H,24,26)