N-[1-azanyl-3-(4-fluorophenyl)sulfanyl-1-oxidanylidene-propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[1-azanyl-3-(4-fluorophenyl)sulfanyl-1-oxidanylidene-propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Openeye Name: N-[2-amino-1-[(4-fluorophenyl)sulfanylmethyl]-2-oxo-ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: N-[1-amino-3-[(4-fluorophenyl)thio]-1-oxopropan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide IUPAC Name: N-[1-amino-3-(4-fluorophenyl)sulfanyl-1-oxopropan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Traditional Name: N-[2-amino-1-[[(4-fluorophenyl)thio]methyl]-2-keto-ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C22H18FN5O2S MolecularWeight: 435.474023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1F)SCC(C(=O)N)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=NC=C4

Isomeric SMILES

C1=CC(=CC=C1F)SCC(C(=O)N)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=NC=C4

InChI

InChI=1S/C22H18FN5O2S/c23-15-2-4-16(5-3-15)31-12-19(20(24)29)28-22(30)14-1-6-17-18(11-14)27-21(26-17)13-7-9-25-10-8-13/h1-11,19H,12H2,(H2,24,29)(H,26,27)(H,28,30)