3-[(4-bromophenyl)methyl]-1-ethyl-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 3-[(4-bromophenyl)methyl]-1-ethyl-2,4-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 3-[(4-bromophenyl)methyl]-1-ethyl-2,4-dioxo-pyrimidine-5-carbonitrile CAS Name: 3-[(4-bromophenyl)methyl]-1-ethyl-2,4-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 3-[(4-bromophenyl)methyl]-1-ethyl-2,4-dioxopyrimidine-5-carbonitrile Traditional Name: 3-(4-bromobenzyl)-1-ethyl-2,4-diketo-pyrimidine-5-carbonitrile Formula: C14H12BrN3O2 MolecularWeight: 334.16798

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)N(C1=O)CC2=CC=C(C=C2)Br)C#N

Isomeric SMILES

CCN1C=C(C(=O)N(C1=O)CC2=CC=C(C=C2)Br)C#N

InChI

InChI=1S/C14H12BrN3O2/c1-2-17-9-11(7-16)13(19)18(14(17)20)8-10-3-5-12(15)6-4-10/h3-6,9H,2,8H2,1H3