N-cyclopentyl-N-[[4-[2-[5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3-pyridin-4-yl-1H-1,2,4-triazol-2-yl]ethoxy]phenyl]methyl]cyclobutanecarboxamide

Systemtic Name: N-cyclopentyl-N-[[4-[2-[5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-3-pyridin-4-yl-1H-1,2,4-triazol-2-yl]ethoxy]phenyl]methyl]cyclobutanecarboxamide Openeye Name: N-cyclopentyl-N-[[4-[2-[5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3-(4-pyridyl)-1H-1,2,4-triazol-2-yl]ethoxy]phenyl]methyl]cyclobutanecarboxamide CAS Name: N-cyclopentyl-N-[[4-[2-[5-(4-oxo-1-cyclohexa-2,5-dienylidene)-3-pyridin-4-yl-1H-1,2,4-triazol-2-yl]ethoxy]phenyl]methyl]cyclobutanecarboxamide IUPAC Name: N-cyclopentyl-N-[[4-[2-[5-(4-oxocyclohexa-2,5-dien-1-ylidene)-3-pyridin-4-yl-1H-1,2,4-triazol-2-yl]ethoxy]phenyl]methyl]cyclobutanecarboxamide Traditional Name: N-cyclopentyl-N-[4-[2-[5-(4-ketocyclohexa-2,5-dien-1-ylidene)-3-(4-pyridyl)-1H-1,2,4-triazol-2-yl]ethoxy]benzyl]cyclobutanecarboxamide Formula: C32H35N5O3 MolecularWeight: 537.652

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC=C(C=C2)OCCN3C(=NC(=C4C=CC(=O)C=C4)N3)C5=CC=NC=C5)C(=O)C6CCC6

Isomeric SMILES

C1CCC(C1)N(CC2=CC=C(C=C2)OCCN3C(=NC(=C4C=CC(=O)C=C4)N3)C5=CC=NC=C5)C(=O)C6CCC6

InChI

InChI=1S/C32H35N5O3/c38-28-12-10-24(11-13-28)30-34-31(25-16-18-33-19-17-25)37(35-30)20-21-40-29-14-8-23(9-15-29)22-36(27-6-1-2-7-27)32(39)26-4-3-5-26/h8-19,26-27,35H,1-7,20-22H2