2-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-7-phenethyl-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 2-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-7-phenethyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 2-[3-(2,5-dimethylpyrrol-1-yl)-2-thienyl]-7-phenethyl-pyrazolo[1,5-a]pyrimidine CAS Name: 2-[3-(2,5-dimethyl-1-pyrrolyl)-2-thiophenyl]-7-phenethylpyrazolo[1,5-a]pyrimidine IUPAC Name: 2-[3-(2,5-dimethylpyrrol-1-yl)thiophen-2-yl]-7-phenethylpyrazolo[1,5-a]pyrimidine Traditional Name: 2-[3-(2,5-dimethylpyrrol-1-yl)-2-thienyl]-7-phenethyl-pyrazolo[1,5-a]pyrimidine Formula: C24H22N4S MolecularWeight: 398.52328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(SC=C2)C3=NN4C(=CC=NC4=C3)CCC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC=C(N1C2=C(SC=C2)C3=NN4C(=CC=NC4=C3)CCC5=CC=CC=C5)C

InChI

InChI=1S/C24H22N4S/c1-17-8-9-18(2)27(17)22-13-15-29-24(22)21-16-23-25-14-12-20(28(23)26-21)11-10-19-6-4-3-5-7-19/h3-9,12-16H,10-11H2,1-2H3