8-(5-azanyl-2-methyl-2H-pyrrol-3-yl)-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name: 8-(5-azanyl-2-methyl-2H-pyrrol-3-yl)-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-(5-amino-2-methyl-2H-pyrrol-3-yl)-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-(5-amino-2-methyl-2H-pyrrol-3-yl)-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-(5-amino-2-methyl-2H-pyrrol-3-yl)-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-(5-amino-2-methyl-2H-pyrrol-3-yl)-1,3-dipropyl-7H-purine-2,6-quinone Formula: C16H22N6O2 MolecularWeight: 330.38488

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=CC(=NC3C)N

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=CC(=NC3C)N

InChI

InChI=1S/C16H22N6O2/c1-4-6-21-14-12(15(23)22(7-5-2)16(21)24)19-13(20-14)10-8-11(17)18-9(10)3/h8-9H,4-7H2,1-3H3,(H2,17,18)(H,19,20)