N-(1-adamantyl)-8-fluoranyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbothioamide

Systemtic Name: N-(1-adamantyl)-8-fluoranyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbothioamide Openeye Name: N-(1-adamantyl)-8-fluoro-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbothioamide CAS Name: N-(1-adamantyl)-8-fluoro-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbothioamide IUPAC Name: N-(1-adamantyl)-8-fluoro-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbothioamide Traditional Name: N-(1-adamantyl)-8-fluoro-1,3,4,5-tetrahydropyrid[4,3-b]indole-2-carbothioamide Formula: C22H26FN3S MolecularWeight: 383.525343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1NC3=C2C=C(C=C3)F)C(=S)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CC2=C1NC3=C2C=C(C=C3)F)C(=S)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C22H26FN3S/c23-16-1-2-19-17(8-16)18-12-26(4-3-20(18)24-19)21(27)25-22-9-13-5-14(10-22)7-15(6-13)11-22/h1-2,8,13-15,24H,3-7,9-12H2,(H,25,27)