N-(3-chloranyl-4-fluoranyl-phenyl)-2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)ethanamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)ethanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)acetamide CAS Name: N-(3-chloro-4-fluorophenyl)-2-(5H-pyrimido[5,4-b]indol-4-ylthio)acetamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)acetamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2-(5H-pyrimid[5,4-b]indol-4-ylthio)acetamide Formula: C18H12ClFN4OS MolecularWeight: 386.830483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(N2)C(=NC=N3)SCC(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(N2)C(=NC=N3)SCC(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C18H12ClFN4OS/c19-12-7-10(5-6-13(12)20)23-15(25)8-26-18-17-16(21-9-22-18)11-3-1-2-4-14(11)24-17/h1-7,9,24H,8H2,(H,23,25)