7-(phenylmethyl)-2-thiophen-2-yl-3H-purin-6-one

Systemtic Name: 7-(phenylmethyl)-2-thiophen-2-yl-3H-purin-6-one Openeye Name: 7-benzyl-2-(2-thienyl)-3H-purin-6-one CAS Name: 7-(phenylmethyl)-2-thiophen-2-yl-3H-purin-6-one IUPAC Name: 7-benzyl-2-thiophen-2-yl-3H-purin-6-one Traditional Name: 7-benzyl-2-(2-thienyl)-3H-purin-6-one Formula: C16H12N4OS MolecularWeight: 308.35768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)C4=CC=CS4

InChI

InChI=1S/C16H12N4OS/c21-16-13-15(18-14(19-16)12-7-4-8-22-12)17-10-20(13)9-11-5-2-1-3-6-11/h1-8,10H,9H2,(H,18,19,21)