2-[(2-chloranyl-7H-purin-6-yl)sulfanyl]-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-[(2-chloranyl-7H-purin-6-yl)sulfanyl]-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-(2-furylmethyl)acetamide CAS Name: 2-[(2-chloro-7H-purin-6-yl)thio]-N-(2-furanylmethyl)acetamide IUPAC Name: 2-[(2-chloro-7H-purin-6-yl)sulfanyl]-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[(2-chloro-7H-purin-6-yl)thio]-N-(2-furfuryl)acetamide Formula: C12H10ClN5O2S MolecularWeight: 323.7581

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)CSC2=NC(=NC3=C2NC=N3)Cl

Isomeric SMILES

C1=COC(=C1)CNC(=O)CSC2=NC(=NC3=C2NC=N3)Cl

InChI

InChI=1S/C12H10ClN5O2S/c13-12-17-10-9(15-6-16-10)11(18-12)21-5-8(19)14-4-7-2-1-3-20-7/h1-3,6H,4-5H2,(H,14,19)(H,15,16,17,18)