2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]-N-[(Z)-1-thiophen-2-ylethylideneamino]ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]-N-[(Z)-1-thiophen-2-ylethylideneamino]ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-9-yl)-N-[(Z)-1-(2-thienyl)ethylideneamino]acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-9-purinyl)-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-9-yl)-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-9-yl)-N-[(Z)-1-(2-thienyl)ethylideneamino]acetamide Formula: C15H16N6O3S MolecularWeight: 360.39094

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CN1C=NC2=C1N(C(=O)N(C2=O)C)C)C3=CC=CS3

Isomeric SMILES

C/C(=N/NC(=O)CN1C=NC2=C1N(C(=O)N(C2=O)C)C)/C3=CC=CS3

InChI

InChI=1S/C15H16N6O3S/c1-9(10-5-4-6-25-10)17-18-11(22)7-21-8-16-12-13(21)19(2)15(24)20(3)14(12)23/h4-6,8H,7H2,1-3H3,(H,18,22)/b17-9-