2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-[(1-thiophen-2-ylcyclopropyl)methyl]ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-[(1-thiophen-2-ylcyclopropyl)methyl]ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-[[1-(2-thienyl)cyclopropyl]methyl]acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[(1-thiophen-2-ylcyclopropyl)methyl]acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(1-thiophen-2-ylcyclopropyl)methyl]acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-[[1-(2-thienyl)cyclopropyl]methyl]acetamide Formula: C17H19N5O3S MolecularWeight: 373.42946

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NCC3(CC3)C4=CC=CS4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NCC3(CC3)C4=CC=CS4

InChI

InChI=1S/C17H19N5O3S/c1-20-14-13(15(24)21(2)16(20)25)22(10-19-14)8-12(23)18-9-17(5-6-17)11-4-3-7-26-11/h3-4,7,10H,5-6,8-9H2,1-2H3,(H,18,23)