N-[6-acetamido-5-[5-chloranyl-3-(4,6-diacetamidopyrimidin-5-yl)sulfanyl-pyrazin-2-yl]sulfanyl-pyrimidin-4-yl]ethanamide

Systemtic Name: N-[6-acetamido-5-[5-chloranyl-3-(4,6-diacetamidopyrimidin-5-yl)sulfanyl-pyrazin-2-yl]sulfanyl-pyrimidin-4-yl]ethanamide Openeye Name: N-[6-acetamido-5-[5-chloro-3-(4,6-diacetamidopyrimidin-5-yl)sulfanyl-pyrazin-2-yl]sulfanyl-pyrimidin-4-yl]acetamide CAS Name: N-[6-acetamido-5-[[5-chloro-3-[(4,6-diacetamido-5-pyrimidinyl)thio]-2-pyrazinyl]thio]-4-pyrimidinyl]acetamide IUPAC Name: N-[6-acetamido-5-[5-chloro-3-(4,6-diacetamidopyrimidin-5-yl)sulfanylpyrazin-2-yl]sulfanylpyrimidin-4-yl]acetamide Traditional Name: N-[6-acetamido-5-[[5-chloro-3-[(4,6-diacetamidopyrimidin-5-yl)thio]pyrazin-2-yl]thio]pyrimidin-4-yl]acetamide Formula: C20H19ClN10O4S2 MolecularWeight: 563.01246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=NC=N1)NC(=O)C)SC2=NC=C(N=C2SC3=C(N=CN=C3NC(=O)C)NC(=O)C)Cl

Isomeric SMILES

CC(=O)NC1=C(C(=NC=N1)NC(=O)C)SC2=NC=C(N=C2SC3=C(N=CN=C3NC(=O)C)NC(=O)C)Cl

InChI

InChI=1S/C20H19ClN10O4S2/c1-8(32)27-15-13(16(24-6-23-15)28-9(2)33)36-19-20(31-12(21)5-22-19)37-14-17(29-10(3)34)25-7-26-18(14)30-11(4)35/h5-7H,1-4H3,(H2,23,24,27,28,32,33)(H2,25,26,29,30,34,35)