7-butyl-6-(4-phenethylphenyl)-3,4-dihydro-2H-pyrimido[2,1-a]isoquinoline

Systemtic Name: 7-butyl-6-(4-phenethylphenyl)-3,4-dihydro-2H-pyrimido[2,1-a]isoquinoline Openeye Name: 7-butyl-6-(4-phenethylphenyl)-3,4-dihydro-2H-pyrimido[2,1-a]isoquinoline CAS Name: 7-butyl-6-(4-phenethylphenyl)-3,4-dihydro-2H-pyrimido[2,1-a]isoquinoline IUPAC Name: 7-butyl-6-(4-phenethylphenyl)-3,4-dihydro-2H-pyrimido[2,1-a]isoquinoline Traditional Name: 7-butyl-6-(4-phenethylphenyl)-3,4-dihydro-2H-pyrimid[2,1-a]isoquinoline Formula: C30H32N2 MolecularWeight: 420.58848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N2CCCN=C2C3=CC=CC=C31)C4=CC=C(C=C4)CCC5=CC=CC=C5

Isomeric SMILES

CCCCC1=C(N2CCCN=C2C3=CC=CC=C31)C4=CC=C(C=C4)CCC5=CC=CC=C5

InChI

InChI=1S/C30H32N2/c1-2-3-12-27-26-13-7-8-14-28(26)30-31-21-9-22-32(30)29(27)25-19-17-24(18-20-25)16-15-23-10-5-4-6-11-23/h4-8,10-11,13-14,17-20H,2-3,9,12,15-16,21-22H2,1H3