5-chloranyl-2-[(E)-2-[1-(5-pyridin-4-ylpyrimidin-2-yl)piperazin-2-yl]sulfonylethenyl]phenol

Systemtic Name: 5-chloranyl-2-[(E)-2-[1-(5-pyridin-4-ylpyrimidin-2-yl)piperazin-2-yl]sulfonylethenyl]phenol Openeye Name: 5-chloro-2-[(E)-2-[1-[5-(4-pyridyl)pyrimidin-2-yl]piperazin-2-yl]sulfonylvinyl]phenol CAS Name: 5-chloro-2-[(E)-2-[[1-(5-pyridin-4-yl-2-pyrimidinyl)-2-piperazinyl]sulfonyl]ethenyl]phenol IUPAC Name: 5-chloro-2-[(E)-2-[1-(5-pyridin-4-ylpyrimidin-2-yl)piperazin-2-yl]sulfonylethenyl]phenol Traditional Name: 5-chloro-2-[(E)-2-[1-[5-(4-pyridyl)pyrimidin-2-yl]piperazin-2-yl]sulfonylvinyl]phenol Formula: C21H20ClN5O3S MolecularWeight: 457.9332

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)S(=O)(=O)C=CC2=C(C=C(C=C2)Cl)O)C3=NC=C(C=N3)C4=CC=NC=C4

Isomeric SMILES

C1CN(C(CN1)S(=O)(=O)/C=C/C2=C(C=C(C=C2)Cl)O)C3=NC=C(C=N3)C4=CC=NC=C4

InChI

InChI=1S/C21H20ClN5O3S/c22-18-2-1-16(19(28)11-18)5-10-31(29,30)20-14-24-8-9-27(20)21-25-12-17(13-26-21)15-3-6-23-7-4-15/h1-7,10-13,20,24,28H,8-9,14H2/b10-5+