9-[3-(dimethylamino)propyl]-1-methyl-8-(5-methylthiophen-2-yl)-3H-purine-2,6-dione

Systemtic Name: 9-[3-(dimethylamino)propyl]-1-methyl-8-(5-methylthiophen-2-yl)-3H-purine-2,6-dione Openeye Name: 9-[3-(dimethylamino)propyl]-1-methyl-8-(5-methyl-2-thienyl)-3H-purine-2,6-dione CAS Name: 9-[3-(dimethylamino)propyl]-1-methyl-8-(5-methyl-2-thiophenyl)-3H-purine-2,6-dione IUPAC Name: 9-[3-(dimethylamino)propyl]-1-methyl-8-(5-methylthiophen-2-yl)-3H-purine-2,6-dione Traditional Name: 9-[3-(dimethylamino)propyl]-1-methyl-8-(5-methyl-2-thienyl)xanthine Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=NC3=C(N2CCCN(C)C)NC(=O)N(C3=O)C

Isomeric SMILES

CC1=CC=C(S1)C2=NC3=C(N2CCCN(C)C)NC(=O)N(C3=O)C

InChI

InChI=1S/C16H21N5O2S/c1-10-6-7-11(24-10)13-17-12-14(18-16(23)20(4)15(12)22)21(13)9-5-8-19(2)3/h6-7H,5,8-9H2,1-4H3,(H,18,23)