[4-[(E)-[(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)hydrazinylidene]methyl]phenyl] ethanoate

Systemtic Name: [4-[(E)-[(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)hydrazinylidene]methyl]phenyl] ethanoate Openeye Name: [4-[(E)-[(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)hydrazono]methyl]phenyl] acetate CAS Name: acetic acid [4-[(E)-[[2,6-bis(1-pyrrolidinyl)-4-pyrimidinyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)hydrazinylidene]methyl]phenyl] acetate Traditional Name: acetic acid [4-[(E)-[(2,6-dipyrrolidinopyrimidin-4-yl)hydrazono]methyl]phenyl] ester Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C=NNC2=NC(=NC(=C2)N3CCCC3)N4CCCC4

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)/C=N/NC2=NC(=NC(=C2)N3CCCC3)N4CCCC4

InChI

InChI=1S/C21H26N6O2/c1-16(28)29-18-8-6-17(7-9-18)15-22-25-19-14-20(26-10-2-3-11-26)24-21(23-19)27-12-4-5-13-27/h6-9,14-15H,2-5,10-13H2,1H3,(H,23,24,25)/b22-15+