2-butan-2-yl-4-[5-[4-(4-hydroxyphenyl)piperazin-1-yl]pyridin-2-yl]-1,2,4-triazolidin-3-one

Systemtic Name: 2-butan-2-yl-4-[5-[4-(4-hydroxyphenyl)piperazin-1-yl]pyridin-2-yl]-1,2,4-triazolidin-3-one Openeye Name: 4-[5-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-pyridyl]-2-sec-butyl-1,2,4-triazolidin-3-one CAS Name: 2-butan-2-yl-4-[5-[4-(4-hydroxyphenyl)-1-piperazinyl]-2-pyridinyl]-1,2,4-triazolidin-3-one IUPAC Name: 2-butan-2-yl-4-[5-[4-(4-hydroxyphenyl)piperazin-1-yl]pyridin-2-yl]-1,2,4-triazolidin-3-one Traditional Name: 4-[5-[4-(4-hydroxyphenyl)piperazino]-2-pyridyl]-2-sec-butyl-1,2,4-triazolidin-3-one Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)N(CN1)C2=NC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

CCC(C)N1C(=O)N(CN1)C2=NC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C21H28N6O2/c1-3-16(2)27-21(29)26(15-23-27)20-9-6-18(14-22-20)25-12-10-24(11-13-25)17-4-7-19(28)8-5-17/h4-9,14,16,23,28H,3,10-13,15H2,1-2H3