2-[1-butyl-6-oxidanyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2,2-bis(4-dimethylaminophenyl)ethanenitrile

Systemtic Name: 2-[1-butyl-6-oxidanyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2,2-bis(4-dimethylaminophenyl)ethanenitrile Openeye Name: 2-(1-butyl-6-hydroxy-2,4-dioxo-pyrimidin-5-yl)-2,2-bis(4-dimethylaminophenyl)acetonitrile CAS Name: 2-(1-butyl-6-hydroxy-2,4-dioxo-5-pyrimidinyl)-2,2-bis(4-dimethylaminophenyl)acetonitrile IUPAC Name: 2-(1-butyl-6-hydroxy-2,4-dioxopyrimidin-5-yl)-2,2-bis(4-dimethylaminophenyl)acetonitrile Traditional Name: 2-(1-butyl-6-hydroxy-2,4-diketo-pyrimidin-5-yl)-2,2-bis(4-dimethylaminophenyl)acetonitrile Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)C(C#N)(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)O

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)C(C#N)(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)O

InChI

InChI=1S/C26H31N5O3/c1-6-7-16-31-24(33)22(23(32)28-25(31)34)26(17-27,18-8-12-20(13-9-18)29(2)3)19-10-14-21(15-11-19)30(4)5/h8-15,33H,6-7,16H2,1-5H3,(H,28,32,34)