2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-[(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-[(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-[(4-isopropylphenyl)-(2-thienyl)methyl]acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-[p-cumenyl(2-thienyl)methyl]acetamide Formula: C23H25N5O3S MolecularWeight: 451.5413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CN3C=NC4=C3C(=O)N(C(=O)N4C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CN3C=NC4=C3C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C23H25N5O3S/c1-14(2)15-7-9-16(10-8-15)19(17-6-5-11-32-17)25-18(29)12-28-13-24-21-20(28)22(30)27(4)23(31)26(21)3/h5-11,13-14,19H,12H2,1-4H3,(H,25,29)