1,3-dimethyl-8-[2-(2-oxidanylideneindol-3-yl)hydrazinyl]-7-propyl-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-[2-(2-oxidanylideneindol-3-yl)hydrazinyl]-7-propyl-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-[2-(2-oxoindol-3-yl)hydrazino]-7-propyl-purine-2,6-dione CAS Name: 1,3-dimethyl-8-[(2-oxo-3-indolyl)hydrazo]-7-propylpurine-2,6-dione IUPAC Name: 1,3-dimethyl-8-[2-(2-oxoindol-3-yl)hydrazinyl]-7-propylpurine-2,6-dione Traditional Name: 8-[N'-(2-ketoindol-3-yl)hydrazino]-1,3-dimethyl-7-propyl-xanthine Formula: C18H19N7O3 MolecularWeight: 381.38856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(N=C1NNC3=C4C=CC=CC4=NC3=O)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCN1C2=C(N=C1NNC3=C4C=CC=CC4=NC3=O)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C18H19N7O3/c1-4-9-25-13-14(23(2)18(28)24(3)16(13)27)20-17(25)22-21-12-10-7-5-6-8-11(10)19-15(12)26/h5-8H,4,9H2,1-3H3,(H,20,22)(H,19,21,26)