methyl 2-[4-[[2-[(E)-dimethylaminomethylideneamino]-4-oxidanylidene-6-propyl-1H-pyrimidin-5-yl]methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[[2-[(E)-dimethylaminomethylideneamino]-4-oxidanylidene-6-propyl-1H-pyrimidin-5-yl]methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[[2-[(E)-dimethylaminomethyleneamino]-4-oxo-6-propyl-1H-pyrimidin-5-yl]methyl]phenyl]benzoate CAS Name: 2-[4-[[2-[(E)-dimethylaminomethylideneamino]-4-oxo-6-propyl-1H-pyrimidin-5-yl]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[2-[(E)-dimethylaminomethylideneamino]-4-oxo-6-propyl-1H-pyrimidin-5-yl]methyl]phenyl]benzoate Traditional Name: 2-[4-[[2-[(E)-dimethylaminomethyleneamino]-4-keto-6-propyl-1H-pyrimidin-5-yl]methyl]phenyl]benzoic acid methyl ester Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)N=C(N1)N=CN(C)C)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CCCC1=C(C(=O)N=C(N1)/N=C/N(C)C)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C25H28N4O3/c1-5-8-22-21(23(30)28-25(27-22)26-16-29(2)3)15-17-11-13-18(14-12-17)19-9-6-7-10-20(19)24(31)32-4/h6-7,9-14,16H,5,8,15H2,1-4H3,(H,27,28,30)/b26-16+