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

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(thiophen-2-ylmethyl)propanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(2-thienylmethyl)propanamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(thiophen-2-ylmethyl)propanamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(thiophen-2-ylmethyl)propanamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(2-thenyl)propionamide Formula: C15H17N5O3S MolecularWeight: 347.39218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)N2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC(C(=O)NCC1=CC=CS1)N2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C15H17N5O3S/c1-9(13(21)16-7-10-5-4-6-24-10)20-8-17-12-11(20)14(22)19(3)15(23)18(12)2/h4-6,8-9H,7H2,1-3H3,(H,16,21)