(8Z)-1-methyl-8-(3-methyl-1H-benzimidazol-2-ylidene)-9-propyl-purine-2,6-dione

Systemtic Name: (8Z)-1-methyl-8-(3-methyl-1H-benzimidazol-2-ylidene)-9-propyl-purine-2,6-dione Openeye Name: (8Z)-1-methyl-8-(3-methyl-1H-benzimidazol-2-ylidene)-9-propyl-purine-2,6-dione CAS Name: (8Z)-1-methyl-8-(3-methyl-1H-benzimidazol-2-ylidene)-9-propylpurine-2,6-dione IUPAC Name: (8Z)-1-methyl-8-(3-methyl-1H-benzimidazol-2-ylidene)-9-propylpurine-2,6-dione Traditional Name: (8Z)-1-methyl-8-(3-methyl-1H-benzimidazol-2-ylidene)-9-propyl-xanthine Formula: C17H18N6O2 MolecularWeight: 338.36382

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C2NC3=CC=CC=C3N2C)N=C4C1=NC(=O)N(C4=O)C

Isomeric SMILES

CCCN1/C(=C\2/NC3=CC=CC=C3N2C)/N=C4C1=NC(=O)N(C4=O)C

InChI

InChI=1S/C17H18N6O2/c1-4-9-23-13-12(16(24)22(3)17(25)20-13)19-15(23)14-18-10-7-5-6-8-11(10)21(14)2/h5-8,18H,4,9H2,1-3H3/b15-14-