[4-[[(2R)-2-(1-ethylbenzimidazol-2-yl)sulfanylpropanoyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide

Systemtic Name: [4-[[(2R)-2-(1-ethylbenzimidazol-2-yl)sulfanylpropanoyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide Openeye Name: [4-[[(2R)-2-(1-ethylbenzimidazol-2-yl)sulfanylpropanoyl]amino]phenyl]sulfonyl-pyrimidin-2-yl-azanide CAS Name: [4-[[(2R)-2-[(1-ethyl-2-benzimidazolyl)thio]-1-oxopropyl]amino]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: [4-[[(2R)-2-(1-ethylbenzimidazol-2-yl)sulfanylpropanoyl]amino]phenyl]sulfonyl-pyrimidin-2-ylazanide Traditional Name: [4-[[(2R)-2-[(1-ethylbenzimidazol-2-yl)thio]propanoyl]amino]phenyl]sulfonyl-(2-pyrimidyl)azanide Formula: C22H21N6O3S2- MolecularWeight: 481.57054

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)[N-]C4=NC=CC=N4

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1S[C@H](C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)[N-]C4=NC=CC=N4

InChI

InChI=1S/C22H22N6O3S2/c1-3-28-19-8-5-4-7-18(19)26-22(28)32-15(2)20(29)25-16-9-11-17(12-10-16)33(30,31)27-21-23-13-6-14-24-21/h4-15H,3H2,1-2H3,(H2,23,24,25,27,29)/p-1/t15-/m1/s1