2-[[4-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]phenyl]methyl]guanidine

Systemtic Name: 2-[[4-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]phenyl]methyl]guanidine Openeye Name: 2-[[4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)phenyl]methyl]guanidine CAS Name: 2-[[4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)phenyl]methyl]guanidine IUPAC Name: 2-[[4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)phenyl]methyl]guanidine Traditional Name: 2-[4-(2,6-diketo-1,3-dipropyl-7H-purin-8-yl)benzyl]guanidine Formula: C19H25N7O2 MolecularWeight: 383.4475

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N7O2/c1-3-9-25-16-14(17(27)26(10-4-2)19(25)28)23-15(24-16)13-7-5-12(6-8-13)11-22-18(20)21/h5-8H,3-4,9-11H2,1-2H3,(H,23,24)(H4,20,21,22)