8-[1-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name: 8-[1-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-[1-methyl-2-(2-methylthiazol-4-yl)ethyl]-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-[1-(2-methyl-4-thiazolyl)propan-2-yl]-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-[1-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-[1-methyl-2-(2-methylthiazol-4-yl)ethyl]-1,3-dipropyl-7H-purine-2,6-quinone Formula: C18H25N5O2S MolecularWeight: 375.4884

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C(C)CC3=CSC(=N3)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C(C)CC3=CSC(=N3)C

InChI

InChI=1S/C18H25N5O2S/c1-5-7-22-16-14(17(24)23(8-6-2)18(22)25)20-15(21-16)11(3)9-13-10-26-12(4)19-13/h10-11H,5-9H2,1-4H3,(H,20,21)