4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzenecarbonitrile

Systemtic Name: 4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzenecarbonitrile Openeye Name: 4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzonitrile CAS Name: 4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzonitrile IUPAC Name: 4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzonitrile Traditional Name: 4-(6-hexyl-5,6,7,8-tetrahydroquinazolin-2-yl)benzonitrile Formula: C21H25N3 MolecularWeight: 319.4433

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H25N3/c1-2-3-4-5-6-16-9-12-20-19(13-16)15-23-21(24-20)18-10-7-17(14-22)8-11-18/h7-8,10-11,15-16H,2-6,9,12-13H2,1H3