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

Systemtic Name: 4-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]-N'-methyl-benzenecarboximidamide Openeye Name: 4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)-N'-methyl-benzamidine CAS Name: 4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)-N'-methylbenzenecarboximidamide IUPAC Name: 4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)-N'-methylbenzenecarboximidamide Traditional Name: 4-(2,6-diketo-1,3-dipropyl-7H-purin-8-yl)-N'-methyl-benzamidine Formula: C19H24N6O2 MolecularWeight: 368.43286

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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)C(=NC)N

Isomeric SMILES

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

InChI

InChI=1S/C19H24N6O2/c1-4-10-24-17-14(18(26)25(11-5-2)19(24)27)22-16(23-17)13-8-6-12(7-9-13)15(20)21-3/h6-9H,4-5,10-11H2,1-3H3,(H2,20,21)(H,22,23)