6-azanyl-1-cyclopropyl-5-[2-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1-cyclopropyl-5-[2-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-cyclopropyl-5-[2-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1-cyclopropyl-5-[2-[(2-methyl-6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]-1-oxoethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-cyclopropyl-5-[2-(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-cyclopropyl-5-[2-[(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)thio]acetyl]pyrimidine-2,4-quinone Formula: C22H19N5O3S2 MolecularWeight: 465.54796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=N1)SCC(=O)C4=C(N(C(=O)NC4=O)C5CC5)N

Isomeric SMILES

CC1=NC2=C(C=C(S2)C3=CC=CC=C3)C(=N1)SCC(=O)C4=C(N(C(=O)NC4=O)C5CC5)N

InChI

InChI=1S/C22H19N5O3S2/c1-11-24-20(14-9-16(32-21(14)25-11)12-5-3-2-4-6-12)31-10-15(28)17-18(23)27(13-7-8-13)22(30)26-19(17)29/h2-6,9,13H,7-8,10,23H2,1H3,(H,26,29,30)