N-ethyl-N-(4-ethylphenyl)-7,8,9,10-tetrahydro-6H-purino[9,8-a]azepin-4-amine

Systemtic Name: N-ethyl-N-(4-ethylphenyl)-7,8,9,10-tetrahydro-6H-purino[9,8-a]azepin-4-amine Openeye Name: N-ethyl-N-(4-ethylphenyl)-7,8,9,10-tetrahydro-6H-purino[9,8-a]azepin-4-amine CAS Name: N-ethyl-N-(4-ethylphenyl)-7,8,9,10-tetrahydro-6H-purino[9,8-a]azepin-4-amine IUPAC Name: N-ethyl-N-(4-ethylphenyl)-7,8,9,10-tetrahydro-6H-purino[9,8-a]azepin-4-amine Traditional Name: ethyl-(4-ethylphenyl)-(7,8,9,10-tetrahydro-6H-purin[9,8-a]azepin-4-yl)amine Formula: C20H25N5 MolecularWeight: 335.446

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CC)C2=NC=NC3=C2N=C4N3CCCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)N(CC)C2=NC=NC3=C2N=C4N3CCCCC4

InChI

InChI=1S/C20H25N5/c1-3-15-9-11-16(12-10-15)24(4-2)19-18-20(22-14-21-19)25-13-7-5-6-8-17(25)23-18/h9-12,14H,3-8,13H2,1-2H3