4-[[(E)-3-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-prop-1-enyl]amino]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[[(E)-3-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-prop-1-enyl]amino]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[[(E)-3-(1-methylbenzimidazol-2-yl)-3-oxo-prop-1-enyl]amino]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[[(E)-3-(1-methyl-2-benzimidazolyl)-3-oxoprop-1-enyl]amino]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[[(E)-3-(1-methylbenzimidazol-2-yl)-3-oxoprop-1-enyl]amino]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[[(E)-3-keto-3-(1-methylbenzimidazol-2-yl)prop-1-enyl]amino]-N-(2-pyrimidyl)benzenesulfonamide Formula: C21H18N6O3S MolecularWeight: 434.47102

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(=O)C=CNC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C(=O)/C=C/NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

InChI

InChI=1S/C21H18N6O3S/c1-27-18-6-3-2-5-17(18)25-20(27)19(28)11-14-22-15-7-9-16(10-8-15)31(29,30)26-21-23-12-4-13-24-21/h2-14,22H,1H3,(H,23,24,26)/b14-11+