9-(oxan-2-yl)-6-[(E)-2-thiophen-2-ylethenyl]purine

Systemtic Name: 9-(oxan-2-yl)-6-[(E)-2-thiophen-2-ylethenyl]purine Openeye Name: 9-tetrahydropyran-2-yl-6-[(E)-2-(2-thienyl)vinyl]purine CAS Name: 9-(2-oxanyl)-6-[(E)-2-thiophen-2-ylethenyl]purine IUPAC Name: 9-(oxan-2-yl)-6-[(E)-2-thiophen-2-ylethenyl]purine Traditional Name: 9-tetrahydropyran-2-yl-6-[(E)-2-(2-thienyl)vinyl]purine Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)N2C=NC3=C(N=CN=C32)C=CC4=CC=CS4

Isomeric SMILES

C1CCOC(C1)N2C=NC3=C(N=CN=C32)/C=C/C4=CC=CS4

InChI

InChI=1S/C16H16N4OS/c1-2-8-21-14(5-1)20-11-19-15-13(17-10-18-16(15)20)7-6-12-4-3-9-22-12/h3-4,6-7,9-11,14H,1-2,5,8H2/b7-6+