N-[3-(2-oxidanylideneazepan-1-yl)propyl]-7-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: N-[3-(2-oxidanylideneazepan-1-yl)propyl]-7-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: N-[3-(2-oxoazepan-1-yl)propyl]-7-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: N-[3-(2-oxo-1-azepanyl)propyl]-7-phenyl-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-[3-(2-oxoazepan-1-yl)propyl]-7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-7-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2=C3N=CC=C(N3N=C2)C4=CC=CC=C4

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2=C3N=CC=C(N3N=C2)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5O2/c28-20-10-5-2-6-14-26(20)15-7-12-24-22(29)18-16-25-27-19(11-13-23-21(18)27)17-8-3-1-4-9-17/h1,3-4,8-9,11,13,16H,2,5-7,10,12,14-15H2,(H,24,29)