4-[4-[2,5-bis(chloranyl)phenyl]sulfonylpiperazin-1-yl]-6-pyrazol-1-yl-pyrimidine

Systemtic Name: 4-[4-[2,5-bis(chloranyl)phenyl]sulfonylpiperazin-1-yl]-6-pyrazol-1-yl-pyrimidine Openeye Name: 4-[4-(2,5-dichlorophenyl)sulfonylpiperazin-1-yl]-6-pyrazol-1-yl-pyrimidine CAS Name: 4-[4-(2,5-dichlorophenyl)sulfonyl-1-piperazinyl]-6-(1-pyrazolyl)pyrimidine IUPAC Name: 4-[4-(2,5-dichlorophenyl)sulfonylpiperazin-1-yl]-6-pyrazol-1-ylpyrimidine Traditional Name: 4-[4-(2,5-dichlorophenyl)sulfonylpiperazino]-6-pyrazol-1-yl-pyrimidine Formula: C17H16Cl2N6O2S MolecularWeight: 439.31894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC(=C2)N3C=CC=N3)S(=O)(=O)C4=C(C=CC(=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=NC(=C2)N3C=CC=N3)S(=O)(=O)C4=C(C=CC(=C4)Cl)Cl

InChI

InChI=1S/C17H16Cl2N6O2S/c18-13-2-3-14(19)15(10-13)28(26,27)24-8-6-23(7-9-24)16-11-17(21-12-20-16)25-5-1-4-22-25/h1-5,10-12H,6-9H2