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

Systemtic Name: 6-azanyl-1-cyclopropyl-5-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-cyclopropyl-5-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1-cyclopropyl-5-[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-cyclopropyl-5-[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-cyclopropyl-5-[2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]acetyl]pyrimidine-2,4-quinone Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)C3=C(N(C(=O)NC3=O)C4CC4)N

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)C3=C(N(C(=O)NC3=O)C4CC4)N

InChI

InChI=1S/C20H19N5O3S/c1-11-9-14(12-5-3-2-4-6-12)23-19(22-11)29-10-15(26)16-17(21)25(13-7-8-13)20(28)24-18(16)27/h2-6,9,13H,7-8,10,21H2,1H3,(H,24,27,28)