4-[(2Z)-2-[1-(1-adamantylmethyl)-3-methyl-5-oxidanylidene-4,4-dipyridin-4-yl-imidazolidin-2-ylidene]ethanoyl]benzenecarbonitrile

Systemtic Name: 4-[(2Z)-2-[1-(1-adamantylmethyl)-3-methyl-5-oxidanylidene-4,4-dipyridin-4-yl-imidazolidin-2-ylidene]ethanoyl]benzenecarbonitrile Openeye Name: 4-[(2Z)-2-[1-(1-adamantylmethyl)-3-methyl-5-oxo-4,4-bis(4-pyridyl)imidazolidin-2-ylidene]acetyl]benzonitrile CAS Name: 4-[(2Z)-2-[1-(1-adamantylmethyl)-3-methyl-5-oxo-4,4-dipyridin-4-yl-2-imidazolidinylidene]-1-oxoethyl]benzonitrile IUPAC Name: 4-[(2Z)-2-[1-(1-adamantylmethyl)-3-methyl-5-oxo-4,4-dipyridin-4-ylimidazolidin-2-ylidene]acetyl]benzonitrile Traditional Name: 4-[(2Z)-2-[1-(1-adamantylmethyl)-5-keto-3-methyl-4,4-bis(4-pyridyl)imidazolidin-2-ylidene]acetyl]benzonitrile Formula: C34H33N5O2 MolecularWeight: 543.65812

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)C2=CC=C(C=C2)C#N)N(C(=O)C1(C3=CC=NC=C3)C4=CC=NC=C4)CC56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CN1/C(=C/C(=O)C2=CC=C(C=C2)C#N)/N(C(=O)C1(C3=CC=NC=C3)C4=CC=NC=C4)CC56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C34H33N5O2/c1-38-31(17-30(40)27-4-2-23(21-35)3-5-27)39(22-33-18-24-14-25(19-33)16-26(15-24)20-33)32(41)34(38,28-6-10-36-11-7-28)29-8-12-37-13-9-29/h2-13,17,24-26H,14-16,18-20,22H2,1H3/b31-17-