[4-[[(2S)-2-(4-acetamidophenyl)sulfanylpropanoyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide

Systemtic Name: [4-[[(2S)-2-(4-acetamidophenyl)sulfanylpropanoyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide Openeye Name: [4-[[(2S)-2-(4-acetamidophenyl)sulfanylpropanoyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide CAS Name: [4-[[(2S)-2-[(4-acetamidophenyl)thio]-1-oxopropyl]amino]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: [4-[[(2S)-2-(4-acetamidophenyl)sulfanylpropanoyl]amino]phenyl]sulfonyl-pyrimidin-2-ylazanide Traditional Name: [4-[[(2S)-2-[(4-acetamidophenyl)thio]propanoyl]amino]phenyl]sulfonyl-(2-pyrimidyl)azanide Formula: C21H20N5O4S2- MolecularWeight: 470.5446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)[N-]C2=NC=CC=N2)SC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)[N-]C2=NC=CC=N2)SC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C21H21N5O4S2/c1-14(31-18-8-4-16(5-9-18)24-15(2)27)20(28)25-17-6-10-19(11-7-17)32(29,30)26-21-22-12-3-13-23-21/h3-14H,1-2H3,(H3,22,23,24,25,26,27,28)/p-1/t14-/m0/s1