N-oxidanyl-2-[4-[(E)-1-oxidanyl-4-(4-phenylphenyl)but-3-en-2-yl]piperazin-1-yl]pyrimidine-5-carboxamide

Systemtic Name: N-oxidanyl-2-[4-[(E)-1-oxidanyl-4-(4-phenylphenyl)but-3-en-2-yl]piperazin-1-yl]pyrimidine-5-carboxamide Openeye Name: 2-[4-[(E)-1-(hydroxymethyl)-3-(4-phenylphenyl)allyl]piperazin-1-yl]pyrimidine-5-carbohydroxamic acid CAS Name: N-hydroxy-2-[4-[(E)-1-hydroxy-4-(4-phenylphenyl)but-3-en-2-yl]-1-piperazinyl]-5-pyrimidinecarboxamide IUPAC Name: N-hydroxy-2-[4-[(E)-1-hydroxy-4-(4-phenylphenyl)but-3-en-2-yl]piperazin-1-yl]pyrimidine-5-carboxamide Traditional Name: 2-[4-[(E)-1-methylol-3-(4-phenylphenyl)allyl]piperazino]pyrimidine-5-carbohydroxamic acid Formula: C25H27N5O3 MolecularWeight: 445.51358

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=N2)C(=O)NO)C(CO)C=CC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=N2)C(=O)NO)C(CO)/C=C/C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N5O3/c31-18-23(11-8-19-6-9-21(10-7-19)20-4-2-1-3-5-20)29-12-14-30(15-13-29)25-26-16-22(17-27-25)24(32)28-33/h1-11,16-17,23,31,33H,12-15,18H2,(H,28,32)/b11-8+