N-(2-bromophenyl)-2-[(8-fluoranyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-bromophenyl)-2-[(8-fluoranyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]ethanamide Openeye Name: N-(2-bromophenyl)-2-[(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide CAS Name: N-(2-bromophenyl)-2-[(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)thio]acetamide IUPAC Name: N-(2-bromophenyl)-2-[(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide Traditional Name: N-(2-bromophenyl)-2-[(8-fluoro-5H-pyrimid[5,4-b]indol-4-yl)thio]acetamide Formula: C18H12BrFN4OS MolecularWeight: 431.281483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CSC2=NC=NC3=C2NC4=C3C=C(C=C4)F)Br

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CSC2=NC=NC3=C2NC4=C3C=C(C=C4)F)Br

InChI

InChI=1S/C18H12BrFN4OS/c19-12-3-1-2-4-14(12)23-15(25)8-26-18-17-16(21-9-22-18)11-7-10(20)5-6-13(11)24-17/h1-7,9,24H,8H2,(H,23,25)