N-butyl-3,6-bis(3,5-dimethylphenyl)-5-(phenylmethyl)pyrazin-2-amine

Systemtic Name: N-butyl-3,6-bis(3,5-dimethylphenyl)-5-(phenylmethyl)pyrazin-2-amine Openeye Name: 5-benzyl-N-butyl-3,6-bis(3,5-dimethylphenyl)pyrazin-2-amine CAS Name: N-butyl-3,6-bis(3,5-dimethylphenyl)-5-(phenylmethyl)-2-pyrazinamine IUPAC Name: 5-benzyl-N-butyl-3,6-bis(3,5-dimethylphenyl)pyrazin-2-amine Traditional Name: [5-benzyl-3,6-bis(3,5-dimethylphenyl)pyrazin-2-yl]-butyl-amine Formula: C31H35N3 MolecularWeight: 449.6297

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=C(N=C1C2=CC(=CC(=C2)C)C)CC3=CC=CC=C3)C4=CC(=CC(=C4)C)C

Isomeric SMILES

CCCCNC1=NC(=C(N=C1C2=CC(=CC(=C2)C)C)CC3=CC=CC=C3)C4=CC(=CC(=C4)C)C

InChI

InChI=1S/C31H35N3/c1-6-7-13-32-31-30(27-18-23(4)15-24(5)19-27)33-28(20-25-11-9-8-10-12-25)29(34-31)26-16-21(2)14-22(3)17-26/h8-12,14-19H,6-7,13,20H2,1-5H3,(H,32,34)