6-azanyl-5-[(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-2-oxidanylidene-1-phenyl-pyrimidine-4-carbonitrile

Systemtic Name: 6-azanyl-5-[(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-2-oxidanylidene-1-phenyl-pyrimidine-4-carbonitrile Openeye Name: 6-amino-5-[(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-2-oxo-1-phenyl-pyrimidine-4-carbonitrile CAS Name: 6-amino-5-[(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-2-oxo-1-phenyl-4-pyrimidinecarbonitrile IUPAC Name: 6-amino-5-[(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-2-oxo-1-phenylpyrimidine-4-carbonitrile Traditional Name: 6-amino-5-[(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-2-keto-1-phenyl-pyrimidine-4-carbonitrile Formula: C26H29N5O2 MolecularWeight: 443.54076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CNC2=C(N(C(=O)N=C2C#N)C3=CC=CC=C3)N)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CNC2=C(N(C(=O)N=C2C#N)C3=CC=CC=C3)N)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C26H29N5O2/c1-25(2,3)18-12-16(13-19(22(18)32)26(4,5)6)15-29-21-20(14-27)30-24(33)31(23(21)28)17-10-8-7-9-11-17/h7-13,15,29H,28H2,1-6H3