1-[4-(7-azanyl-3-bromanyl-pyrazolo[1,5-a]pyrimidin-6-yl)phenyl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[4-(7-azanyl-3-bromanyl-pyrazolo[1,5-a]pyrimidin-6-yl)phenyl]-3-(3-methylphenyl)urea Openeye Name: 1-[4-(7-amino-3-bromo-pyrazolo[1,5-a]pyrimidin-6-yl)phenyl]-3-(m-tolyl)urea CAS Name: 1-[4-(7-amino-3-bromo-6-pyrazolo[1,5-a]pyrimidinyl)phenyl]-3-(3-methylphenyl)urea IUPAC Name: 1-[4-(7-amino-3-bromopyrazolo[1,5-a]pyrimidin-6-yl)phenyl]-3-(3-methylphenyl)urea Traditional Name: 1-[4-(7-amino-3-bromo-pyrazolo[1,5-a]pyrimidin-6-yl)phenyl]-3-(m-tolyl)urea Formula: C20H17BrN6O MolecularWeight: 437.29258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)C3=C(N4C(=C(C=N4)Br)N=C3)N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)C3=C(N4C(=C(C=N4)Br)N=C3)N

InChI

InChI=1S/C20H17BrN6O/c1-12-3-2-4-15(9-12)26-20(28)25-14-7-5-13(6-8-14)16-10-23-19-17(21)11-24-27(19)18(16)22/h2-11H,22H2,1H3,(H2,25,26,28)