6-azanyl-1-methyl-5-[2-(2,3,5,6-tetramethylphenyl)sulfanylethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1-methyl-5-[2-(2,3,5,6-tetramethylphenyl)sulfanylethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-methyl-5-[2-(2,3,5,6-tetramethylphenyl)sulfanylacetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1-methyl-5-[1-oxo-2-[(2,3,5,6-tetramethylphenyl)thio]ethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-methyl-5-[2-(2,3,5,6-tetramethylphenyl)sulfanylacetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-methyl-5-[2-[(2,3,5,6-tetramethylphenyl)thio]acetyl]pyrimidine-2,4-quinone Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)SCC(=O)C2=C(N(C(=O)NC2=O)C)N)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)SCC(=O)C2=C(N(C(=O)NC2=O)C)N)C)C

InChI

InChI=1S/C17H21N3O3S/c1-8-6-9(2)11(4)14(10(8)3)24-7-12(21)13-15(18)20(5)17(23)19-16(13)22/h6H,7,18H2,1-5H3,(H,19,22,23)