N-(1-azanyl-3-naphthalen-2-ylsulfanyl-1-oxidanylidene-propan-2-yl)-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide

Systemtic Name: N-(1-azanyl-3-naphthalen-2-ylsulfanyl-1-oxidanylidene-propan-2-yl)-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Openeye Name: N-[2-amino-1-(2-naphthylsulfanylmethyl)-2-oxo-ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: N-[1-amino-3-(2-naphthalenylthio)-1-oxopropan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide IUPAC Name: N-(1-amino-3-naphthalen-2-ylsulfanyl-1-oxopropan-2-yl)-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Traditional Name: N-[2-amino-2-keto-1-[(2-naphthylthio)methyl]ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C26H21N5O2S MolecularWeight: 467.54224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)SCC(C(=O)N)NC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=NC=C5

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)SCC(C(=O)N)NC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=NC=C5

InChI

InChI=1S/C26H21N5O2S/c27-24(32)23(15-34-20-7-5-16-3-1-2-4-18(16)13-20)31-26(33)19-6-8-21-22(14-19)30-25(29-21)17-9-11-28-12-10-17/h1-14,23H,15H2,(H2,27,32)(H,29,30)(H,31,33)