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

Systemtic Name: 2-[4-[(E)-4-(4-methylphenyl)-1-oxidanyl-but-3-en-2-yl]piperazin-1-yl]-N-oxidanyl-pyrimidine-5-carboxamide Openeye Name: 2-[4-[(E)-1-(hydroxymethyl)-3-(p-tolyl)allyl]piperazin-1-yl]pyrimidine-5-carbohydroxamic acid CAS Name: N-hydroxy-2-[4-[(E)-1-hydroxy-4-(4-methylphenyl)but-3-en-2-yl]-1-piperazinyl]-5-pyrimidinecarboxamide IUPAC Name: N-hydroxy-2-[4-[(E)-1-hydroxy-4-(4-methylphenyl)but-3-en-2-yl]piperazin-1-yl]pyrimidine-5-carboxamide Traditional Name: 2-[4-[(E)-1-methylol-3-(p-tolyl)allyl]piperazino]pyrimidine-5-carbohydroxamic acid Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(CO)N2CCN(CC2)C3=NC=C(C=N3)C(=O)NO

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(CO)N2CCN(CC2)C3=NC=C(C=N3)C(=O)NO

InChI

InChI=1S/C20H25N5O3/c1-15-2-4-16(5-3-15)6-7-18(14-26)24-8-10-25(11-9-24)20-21-12-17(13-22-20)19(27)23-28/h2-7,12-13,18,26,28H,8-11,14H2,1H3,(H,23,27)/b7-6+