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

Systemtic Name: N-[(4-methylphenyl)methyl]-7,8,9,10-tetrahydro-6H-purino[9,8-a]azepin-4-amine Openeye Name: N-(p-tolylmethyl)-7,8,9,10-tetrahydro-6H-purino[9,8-a]azepin-4-amine CAS Name: N-[(4-methylphenyl)methyl]-7,8,9,10-tetrahydro-6H-purino[9,8-a]azepin-4-amine IUPAC Name: N-[(4-methylphenyl)methyl]-7,8,9,10-tetrahydro-6H-purino[9,8-a]azepin-4-amine Traditional Name: (4-methylbenzyl)-(7,8,9,10-tetrahydro-6H-purin[9,8-a]azepin-4-yl)amine Formula: C18H21N5 MolecularWeight: 307.39284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC=NC3=C2N=C4N3CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC=NC3=C2N=C4N3CCCCC4

InChI

InChI=1S/C18H21N5/c1-13-6-8-14(9-7-13)11-19-17-16-18(21-12-20-17)23-10-4-2-3-5-15(23)22-16/h6-9,12H,2-5,10-11H2,1H3,(H,19,20,21)