2-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]sulfanyl]-N-(pyridin-4-ylmethyl)benzamide

Systemtic Name: 2-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]sulfanyl]-N-(pyridin-4-ylmethyl)benzamide Openeye Name: N-(4-pyridylmethyl)-2-[[3-[(E)-2-(2-pyridyl)vinyl]-1H-indazol-6-yl]sulfanyl]benzamide CAS Name: 2-[[3-[(E)-2-(2-pyridinyl)ethenyl]-1H-indazol-6-yl]thio]-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 2-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]sulfanyl]-N-(pyridin-4-ylmethyl)benzamide Traditional Name: N-(4-pyridylmethyl)-2-[[3-[(E)-2-(2-pyridyl)vinyl]-1H-indazol-6-yl]thio]benzamide Formula: C27H21N5OS MolecularWeight: 463.55354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCC2=CC=NC=C2)SC3=CC4=C(C=C3)C(=NN4)C=CC5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCC2=CC=NC=C2)SC3=CC4=C(C=C3)C(=NN4)/C=C/C5=CC=CC=N5

InChI

InChI=1S/C27H21N5OS/c33-27(30-18-19-12-15-28-16-13-19)23-6-1-2-7-26(23)34-21-9-10-22-24(31-32-25(22)17-21)11-8-20-5-3-4-14-29-20/h1-17H,18H2,(H,30,33)(H,31,32)/b11-8+