N-(4-bromophenyl)-2-methyl-3-phenyl-5-propyl-pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: N-(4-bromophenyl)-2-methyl-3-phenyl-5-propyl-pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: N-(4-bromophenyl)-2-methyl-3-phenyl-5-propyl-pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: N-(4-bromophenyl)-2-methyl-3-phenyl-5-propyl-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: N-(4-bromophenyl)-2-methyl-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: (4-bromophenyl)-(2-methyl-3-phenyl-5-propyl-pyrazolo[1,5-a]pyrimidin-7-yl)amine Formula: C22H21BrN4 MolecularWeight: 421.33294

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C(=NN2C(=C1)NC3=CC=C(C=C3)Br)C)C4=CC=CC=C4

Isomeric SMILES

CCCC1=NC2=C(C(=NN2C(=C1)NC3=CC=C(C=C3)Br)C)C4=CC=CC=C4

InChI

InChI=1S/C22H21BrN4/c1-3-7-19-14-20(24-18-12-10-17(23)11-13-18)27-22(25-19)21(15(2)26-27)16-8-5-4-6-9-16/h4-6,8-14,24H,3,7H2,1-2H3