2-azanyl-4-[(6-azanyl-7H-purin-8-yl)sulfanyl]butanoic acid

Systemtic Name: 2-azanyl-4-[(6-azanyl-7H-purin-8-yl)sulfanyl]butanoic acid Openeye Name: 2-amino-4-[(6-amino-7H-purin-8-yl)sulfanyl]butanoic acid CAS Name: 2-amino-4-[(6-amino-7H-purin-8-yl)thio]butanoic acid IUPAC Name: 2-amino-4-[(6-amino-7H-purin-8-yl)sulfanyl]butanoic acid Traditional Name: 2-amino-4-[(6-amino-7H-purin-8-yl)thio]butyric acid Formula: C9H12N6O2S MolecularWeight: 268.29558

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)NC(=N2)SCCC(C(=O)O)N

Isomeric SMILES

C1=NC2=C(C(=N1)N)NC(=N2)SCCC(C(=O)O)N

InChI

InChI=1S/C9H12N6O2S/c10-4(8(16)17)1-2-18-9-14-5-6(11)12-3-13-7(5)15-9/h3-4H,1-2,10H2,(H,16,17)(H3,11,12,13,14,15)