4-(hexylamino)-6-phenyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(hexylamino)-6-phenyl-pyrimidine-5-carbonitrile Openeye Name: 4-(hexylamino)-6-phenyl-pyrimidine-5-carbonitrile CAS Name: 4-(hexylamino)-6-phenyl-5-pyrimidinecarbonitrile IUPAC Name: 4-(hexylamino)-6-phenylpyrimidine-5-carbonitrile Traditional Name: 4-(hexylamino)-6-phenyl-pyrimidine-5-carbonitrile Formula: C17H20N4 MolecularWeight: 280.3675

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=NC=NC(=C1C#N)C2=CC=CC=C2

Isomeric SMILES

CCCCCCNC1=NC=NC(=C1C#N)C2=CC=CC=C2

InChI

InChI=1S/C17H20N4/c1-2-3-4-8-11-19-17-15(12-18)16(20-13-21-17)14-9-6-5-7-10-14/h5-7,9-10,13H,2-4,8,11H2,1H3,(H,19,20,21)