1-(3-chloranylpropyl)-6-oxidanylidene-2,4-diphenyl-pyrimidine-5-carbonitrile

Systemtic Name: 1-(3-chloranylpropyl)-6-oxidanylidene-2,4-diphenyl-pyrimidine-5-carbonitrile Openeye Name: 1-(3-chloropropyl)-6-oxo-2,4-diphenyl-pyrimidine-5-carbonitrile CAS Name: 1-(3-chloropropyl)-6-oxo-2,4-diphenyl-5-pyrimidinecarbonitrile IUPAC Name: 1-(3-chloropropyl)-6-oxo-2,4-diphenylpyrimidine-5-carbonitrile Traditional Name: 1-(3-chloropropyl)-6-keto-2,4-diphenyl-pyrimidine-5-carbonitrile Formula: C20H16ClN3O MolecularWeight: 349.81354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)N(C(=N2)C3=CC=CC=C3)CCCCl)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)N(C(=N2)C3=CC=CC=C3)CCCCl)C#N

InChI

InChI=1S/C20H16ClN3O/c21-12-7-13-24-19(16-10-5-2-6-11-16)23-18(17(14-22)20(24)25)15-8-3-1-4-9-15/h1-6,8-11H,7,12-13H2