5-[[2,5-bis(oxidanylidene)-4,4-dipropyl-imidazolidin-1-yl]methyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-[[2,5-bis(oxidanylidene)-4,4-dipropyl-imidazolidin-1-yl]methyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-[(2,5-dioxo-4,4-dipropyl-imidazolidin-1-yl)methyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-[(2,5-dioxo-4,4-dipropyl-1-imidazolidinyl)methyl]-3-methyl-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-[(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)methyl]-3-methyl-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-[(2,5-diketo-4,4-dipropyl-imidazolidin-1-yl)methyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=O)N(C(=O)N1)CC2=C(C(=NN2C3=CC=CC=C3)C)C#N)CCC

Isomeric SMILES

CCCC1(C(=O)N(C(=O)N1)CC2=C(C(=NN2C3=CC=CC=C3)C)C#N)CCC

InChI

InChI=1S/C21H25N5O2/c1-4-11-21(12-5-2)19(27)25(20(28)23-21)14-18-17(13-22)15(3)24-26(18)16-9-7-6-8-10-16/h6-10H,4-5,11-12,14H2,1-3H3,(H,23,28)