[4-[[(2S)-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanoyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide

Systemtic Name: [4-[[(2S)-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanoyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide Openeye Name: [4-[[(2S)-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanoyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide CAS Name: [4-[[(2S)-2-[(1-cyclopropyl-2-imidazolyl)thio]-1-oxopropyl]amino]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: [4-[[(2S)-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanoyl]amino]phenyl]sulfonyl-pyrimidin-2-ylazanide Traditional Name: [4-[[(2S)-2-[(1-cyclopropylimidazol-2-yl)thio]propanoyl]amino]phenyl]sulfonyl-(2-pyrimidyl)azanide Formula: C19H19N6O3S2- MolecularWeight: 443.52256

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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=NC=CN3C4CC4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)[N-]C2=NC=CC=N2)SC3=NC=CN3C4CC4

InChI

InChI=1S/C19H20N6O3S2/c1-13(29-19-22-11-12-25(19)15-5-6-15)17(26)23-14-3-7-16(8-4-14)30(27,28)24-18-20-9-2-10-21-18/h2-4,7-13,15H,5-6H2,1H3,(H2,20,21,23,24,26)/p-1/t13-/m0/s1