3-(4-bromophenyl)sulfonyl-2-ethyl-5-methyl-7-piperazin-1-yl-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 3-(4-bromophenyl)sulfonyl-2-ethyl-5-methyl-7-piperazin-1-yl-pyrazolo[1,5-a]pyrimidine Openeye Name: 3-(4-bromophenyl)sulfonyl-2-ethyl-5-methyl-7-piperazin-1-yl-pyrazolo[1,5-a]pyrimidine CAS Name: 3-(4-bromophenyl)sulfonyl-2-ethyl-5-methyl-7-(1-piperazinyl)pyrazolo[1,5-a]pyrimidine IUPAC Name: 3-(4-bromophenyl)sulfonyl-2-ethyl-5-methyl-7-piperazin-1-ylpyrazolo[1,5-a]pyrimidine Traditional Name: 3-brosyl-2-ethyl-5-methyl-7-piperazino-pyrazolo[1,5-a]pyrimidine Formula: C19H22BrN5O2S MolecularWeight: 464.37928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN2C(=CC(=NC2=C1S(=O)(=O)C3=CC=C(C=C3)Br)C)N4CCNCC4

Isomeric SMILES

CCC1=NN2C(=CC(=NC2=C1S(=O)(=O)C3=CC=C(C=C3)Br)C)N4CCNCC4

InChI

InChI=1S/C19H22BrN5O2S/c1-3-16-18(28(26,27)15-6-4-14(20)5-7-15)19-22-13(2)12-17(25(19)23-16)24-10-8-21-9-11-24/h4-7,12,21H,3,8-11H2,1-2H3