3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(1-ethylbenzimidazol-2-yl)propanamide

Systemtic Name: 3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(1-ethylbenzimidazol-2-yl)propanamide Openeye Name: 3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(1-ethylbenzimidazol-2-yl)propanamide CAS Name: 3-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(1-ethyl-2-benzimidazolyl)propanamide IUPAC Name: 3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(1-ethylbenzimidazol-2-yl)propanamide Traditional Name: 3-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(1-ethylbenzimidazol-2-yl)propionamide Formula: C19H21N7O3 MolecularWeight: 395.41514

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1NC(=O)CCN3C=NC4=C3C(=O)N(C(=O)N4C)C

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1NC(=O)CCN3C=NC4=C3C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C19H21N7O3/c1-4-26-13-8-6-5-7-12(13)21-18(26)22-14(27)9-10-25-11-20-16-15(25)17(28)24(3)19(29)23(16)2/h5-8,11H,4,9-10H2,1-3H3,(H,21,22,27)