4-[6-(2-ethylhexyl)-5,6,7,8-tetrahydroquinazolin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[6-(2-ethylhexyl)-5,6,7,8-tetrahydroquinazolin-2-yl]benzenecarbonitrile Openeye Name: 4-[6-(2-ethylhexyl)-5,6,7,8-tetrahydroquinazolin-2-yl]benzonitrile CAS Name: 4-[6-(2-ethylhexyl)-5,6,7,8-tetrahydroquinazolin-2-yl]benzonitrile IUPAC Name: 4-[6-(2-ethylhexyl)-5,6,7,8-tetrahydroquinazolin-2-yl]benzonitrile Traditional Name: 4-[6-(2-ethylhexyl)-5,6,7,8-tetrahydroquinazolin-2-yl]benzonitrile Formula: C23H29N3 MolecularWeight: 347.49646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCC(CC)CC1CCC2=NC(=NC=C2C1)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H29N3/c1-3-5-6-17(4-2)13-19-9-12-22-21(14-19)16-25-23(26-22)20-10-7-18(15-24)8-11-20/h7-8,10-11,16-17,19H,3-6,9,12-14H2,1-2H3