3-(3-methoxypropyl)-1-propyl-8-thiophen-2-yl-7H-purine-2,6-dione

Systemtic Name: 3-(3-methoxypropyl)-1-propyl-8-thiophen-2-yl-7H-purine-2,6-dione Openeye Name: 3-(3-methoxypropyl)-1-propyl-8-(2-thienyl)-7H-purine-2,6-dione CAS Name: 3-(3-methoxypropyl)-1-propyl-8-thiophen-2-yl-7H-purine-2,6-dione IUPAC Name: 3-(3-methoxypropyl)-1-propyl-8-thiophen-2-yl-7H-purine-2,6-dione Traditional Name: 3-(3-methoxypropyl)-1-propyl-8-(2-thienyl)-7H-purine-2,6-quinone Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2)C3=CC=CS3)N(C1=O)CCCOC

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2)C3=CC=CS3)N(C1=O)CCCOC

InChI

InChI=1S/C16H20N4O3S/c1-3-7-20-15(21)12-14(19(16(20)22)8-5-9-23-2)18-13(17-12)11-6-4-10-24-11/h4,6,10H,3,5,7-9H2,1-2H3,(H,17,18)