3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-[(5-methylthiophen-2-yl)methyl]-N-phenethyl-propanamide

Systemtic Name: 3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-[(5-methylthiophen-2-yl)methyl]-N-phenethyl-propanamide Openeye Name: 3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-[(5-methyl-2-thienyl)methyl]-N-phenethyl-propanamide CAS Name: 3-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[(5-methyl-2-thiophenyl)methyl]-N-phenethylpropanamide IUPAC Name: 3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(5-methylthiophen-2-yl)methyl]-N-phenethylpropanamide Traditional Name: 3-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-[(5-methyl-2-thienyl)methyl]-N-phenethyl-propionamide Formula: C24H27N5O3S MolecularWeight: 465.56788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)C(=O)CCN3C=NC4=C3C(=O)N(C(=O)N4C)C

Isomeric SMILES

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)C(=O)CCN3C=NC4=C3C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C24H27N5O3S/c1-17-9-10-19(33-17)15-28(13-11-18-7-5-4-6-8-18)20(30)12-14-29-16-25-22-21(29)23(31)27(3)24(32)26(22)2/h4-10,16H,11-15H2,1-3H3