4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzamide CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[2-(1-phenyl-4-pyrazolyl)ethyl]benzamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzamide Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzamide Formula: C26H23N5OS MolecularWeight: 453.55872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CCNC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CCNC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C26H23N5OS/c32-25(27-15-14-20-16-28-31(17-20)22-6-2-1-3-7-22)21-12-10-19(11-13-21)18-33-26-29-23-8-4-5-9-24(23)30-26/h1-13,16-17H,14-15,18H2,(H,27,32)(H,29,30)