N-phenyl-4-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanylmethyl)benzamide

Systemtic Name: N-phenyl-4-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanylmethyl)benzamide Openeye Name: N-phenyl-4-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanylmethyl)benzamide CAS Name: N-phenyl-4-[(5H-[1,2,4]triazino[5,6-b]indol-3-ylthio)methyl]benzamide IUPAC Name: N-phenyl-4-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanylmethyl)benzamide Traditional Name: N-phenyl-4-[(5H-[1,2,4]triazin[5,6-b]indol-3-ylthio)methyl]benzamide Formula: C23H17N5OS MolecularWeight: 411.47898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NC4=C(C5=CC=CC=C5N4)N=N3

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NC4=C(C5=CC=CC=C5N4)N=N3

InChI

InChI=1S/C23H17N5OS/c29-22(24-17-6-2-1-3-7-17)16-12-10-15(11-13-16)14-30-23-26-21-20(27-28-23)18-8-4-5-9-19(18)25-21/h1-13H,14H2,(H,24,29)(H,25,26,28)