2-[6-chloranyl-2,4-bis(oxidanylidene)-5-phenyl-3-propyl-pyrimidin-1-yl]ethanenitrile

Systemtic Name: 2-[6-chloranyl-2,4-bis(oxidanylidene)-5-phenyl-3-propyl-pyrimidin-1-yl]ethanenitrile Openeye Name: 2-(6-chloro-2,4-dioxo-5-phenyl-3-propyl-pyrimidin-1-yl)acetonitrile CAS Name: 2-(6-chloro-2,4-dioxo-5-phenyl-3-propyl-1-pyrimidinyl)acetonitrile IUPAC Name: 2-(6-chloro-2,4-dioxo-5-phenyl-3-propylpyrimidin-1-yl)acetonitrile Traditional Name: 2-(6-chloro-2,4-diketo-5-phenyl-3-propyl-pyrimidin-1-yl)acetonitrile Formula: C15H14ClN3O2 MolecularWeight: 303.74356

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=C(N(C1=O)CC#N)Cl)C2=CC=CC=C2

Isomeric SMILES

CCCN1C(=O)C(=C(N(C1=O)CC#N)Cl)C2=CC=CC=C2

InChI

InChI=1S/C15H14ClN3O2/c1-2-9-19-14(20)12(11-6-4-3-5-7-11)13(16)18(10-8-17)15(19)21/h3-7H,2,9-10H2,1H3