N-[1-(2-fluoranylethylamino)-1-oxidanylidene-3-phenylsulfanyl-propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[1-(2-fluoranylethylamino)-1-oxidanylidene-3-phenylsulfanyl-propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Openeye Name: N-[2-(2-fluoroethylamino)-2-oxo-1-(phenylsulfanylmethyl)ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: N-[1-(2-fluoroethylamino)-1-oxo-3-(phenylthio)propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide IUPAC Name: N-[1-(2-fluoroethylamino)-1-oxo-3-phenylsulfanylpropan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Traditional Name: N-[2-(2-fluoroethylamino)-2-keto-1-[(phenylthio)methyl]ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C24H22FN5O2S MolecularWeight: 463.527183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(C(=O)NCCF)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)SCC(C(=O)NCCF)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=NC=C4

InChI

InChI=1S/C24H22FN5O2S/c25-10-13-27-24(32)21(15-33-18-4-2-1-3-5-18)30-23(31)17-6-7-19-20(14-17)29-22(28-19)16-8-11-26-12-9-16/h1-9,11-12,14,21H,10,13,15H2,(H,27,32)(H,28,29)(H,30,31)