6-butyl-3-methyl-1-phenyl-2,4-dihydropyrazolo[3,4-b][1,4]diazepine-5,7-dione

Systemtic Name: 6-butyl-3-methyl-1-phenyl-2,4-dihydropyrazolo[3,4-b][1,4]diazepine-5,7-dione Openeye Name: 6-butyl-3-methyl-1-phenyl-2,4-dihydropyrazolo[3,4-b][1,4]diazepine-5,7-dione CAS Name: 6-butyl-3-methyl-1-phenyl-2,4-dihydropyrazolo[3,4-b][1,4]diazepine-5,7-dione IUPAC Name: 6-butyl-3-methyl-1-phenyl-2,4-dihydropyrazolo[3,4-b][1,4]diazepine-5,7-dione Traditional Name: 6-butyl-3-methyl-1-phenyl-2,4-dihydropyrazolo[3,4-b][1,4]diazepine-5,7-quinone Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)NC2=C(NN(C2=NC1=O)C3=CC=CC=C3)C

Isomeric SMILES

CCCCC1C(=O)NC2=C(NN(C2=NC1=O)C3=CC=CC=C3)C

InChI

InChI=1S/C17H20N4O2/c1-3-4-10-13-16(22)18-14-11(2)20-21(15(14)19-17(13)23)12-8-6-5-7-9-12/h5-9,13,20H,3-4,10H2,1-2H3,(H,18,22)