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2-[(6-azanyl-7H-purin-8-yl)sulfanyl]-N-(4-phenoxyphenyl)ethanamide

2-[(6-azanyl-7H-purin-8-yl)sulfanyl]-N-(4-phenoxyphenyl)ethanamide

Systemtic Name:2-[(6-azanyl-7H-purin-8-yl)sulfanyl]-N-(4-phenoxyphenyl)ethanamide
Openeye Name:2-[(6-amino-7H-purin-8-yl)sulfanyl]-N-(4-phenoxyphenyl)acetamide
CAS Name:2-[(6-amino-7H-purin-8-yl)thio]-N-(4-phenoxyphenyl)acetamide
IUPAC Name:2-[(6-amino-7H-purin-8-yl)sulfanyl]-N-(4-phenoxyphenyl)acetamide
Traditional Name:2-[(6-amino-7H-purin-8-yl)thio]-N-(4-phenoxyphenyl)acetamide
Formula: C19H16N6O2S
MolecularWeight: 392.43434
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CSC3=NC4=C(N3)C(=NC=N4)N


Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CSC3=NC4=C(N3)C(=NC=N4)N


InChI

InChI=1S/C19H16N6O2S/c20-17-16-18(22-11-21-17)25-19(24-16)28-10-15(26)23-12-6-8-14(9-7-12)27-13-4-2-1-3-5-13/h1-9,11H,10H2,(H,23,26)(H3,20,21,22,24,25)


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