9-(oxan-2-yl)-6-[(E)-2-thiophen-3-ylethenyl]purine

Systemtic Name: 9-(oxan-2-yl)-6-[(E)-2-thiophen-3-ylethenyl]purine Openeye Name: 9-tetrahydropyran-2-yl-6-[(E)-2-(3-thienyl)vinyl]purine CAS Name: 9-(2-oxanyl)-6-[(E)-2-(3-thiophenyl)ethenyl]purine IUPAC Name: 9-(oxan-2-yl)-6-[(E)-2-thiophen-3-ylethenyl]purine Traditional Name: 9-tetrahydropyran-2-yl-6-[(E)-2-(3-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=CSC=C4

Isomeric SMILES

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

InChI

InChI=1S/C16H16N4OS/c1-2-7-21-14(3-1)20-11-19-15-13(17-10-18-16(15)20)5-4-12-6-8-22-9-12/h4-6,8-11,14H,1-3,7H2/b5-4+