2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[1-(3-sulfamoylphenyl)ethyl]ethanamide

Systemtic Name: 2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[1-(3-sulfamoylphenyl)ethyl]ethanamide Openeye Name: 2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide CAS Name: 2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide IUPAC Name: 2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide Traditional Name: 2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide Formula: C16H18N6O4S MolecularWeight: 390.41692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)S(=O)(=O)N)NC(=O)CN2C=NC3=C(C2=O)C=NN3C

Isomeric SMILES

CC(C1=CC(=CC=C1)S(=O)(=O)N)NC(=O)CN2C=NC3=C(C2=O)C=NN3C

InChI

InChI=1S/C16H18N6O4S/c1-10(11-4-3-5-12(6-11)27(17,25)26)20-14(23)8-22-9-18-15-13(16(22)24)7-19-21(15)2/h3-7,9-10H,8H2,1-2H3,(H,20,23)(H2,17,25,26)