6-[3-[(4-bromanyl-2-methyl-phenyl)amino]-3-oxidanylidene-propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: 6-[3-[(4-bromanyl-2-methyl-phenyl)amino]-3-oxidanylidene-propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: 6-[3-(4-bromo-2-methyl-anilino)-3-oxo-propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: 6-[3-(4-bromo-2-methylanilino)-3-oxopropyl]-5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 6-[3-(4-bromo-2-methylanilino)-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: 6-[3-(4-bromo-2-methyl-anilino)-3-keto-propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C19H20BrN5O2 MolecularWeight: 430.2984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CCC2=C(N3C(=C(C=N3)C(=O)N)N=C2C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CCC2=C(N3C(=C(C=N3)C(=O)N)N=C2C)C

InChI

InChI=1S/C19H20BrN5O2/c1-10-8-13(20)4-6-16(10)24-17(26)7-5-14-11(2)23-19-15(18(21)27)9-22-25(19)12(14)3/h4,6,8-9H,5,7H2,1-3H3,(H2,21,27)(H,24,26)