2-methyl-6-[(E)-2-phenylethenyl]-9-(phenylmethyl)purine

Systemtic Name: 2-methyl-6-[(E)-2-phenylethenyl]-9-(phenylmethyl)purine Openeye Name: 9-benzyl-2-methyl-6-[(E)-styryl]purine CAS Name: 2-methyl-6-[(E)-2-phenylethenyl]-9-(phenylmethyl)purine IUPAC Name: 9-benzyl-2-methyl-6-[(E)-2-phenylethenyl]purine Traditional Name: 9-benzyl-2-methyl-6-[(E)-styryl]purine Formula: C21H18N4 MolecularWeight: 326.39442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=N1)N(C=N2)CC3=CC=CC=C3)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=NC(=C2C(=N1)N(C=N2)CC3=CC=CC=C3)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C21H18N4/c1-16-23-19(13-12-17-8-4-2-5-9-17)20-21(24-16)25(15-22-20)14-18-10-6-3-7-11-18/h2-13,15H,14H2,1H3/b13-12+