N-phenyl-N-propan-2-yl-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)ethanamide

Systemtic Name: N-phenyl-N-propan-2-yl-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)ethanamide Openeye Name: N-isopropyl-N-phenyl-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetamide CAS Name: N-phenyl-N-propan-2-yl-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylthio)acetamide IUPAC Name: N-phenyl-N-propan-2-yl-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetamide Traditional Name: N-isopropyl-N-phenyl-2-(5H-[1,2,4]triazin[5,6-b]indol-3-ylthio)acetamide Formula: C20H19N5OS MolecularWeight: 377.46276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)CSC2=NC3=C(C4=CC=CC=C4N3)N=N2

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)CSC2=NC3=C(C4=CC=CC=C4N3)N=N2

InChI

InChI=1S/C20H19N5OS/c1-13(2)25(14-8-4-3-5-9-14)17(26)12-27-20-22-19-18(23-24-20)15-10-6-7-11-16(15)21-19/h3-11,13H,12H2,1-2H3,(H,21,22,24)