N-(2,3-dipyridin-2-ylquinoxalin-6-yl)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octane-7-carbothioamide

Systemtic Name: N-(2,3-dipyridin-2-ylquinoxalin-6-yl)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octane-7-carbothioamide Openeye Name: N-[2,3-bis(2-pyridyl)quinoxalin-6-yl]-3,3,5-trimethyl-7-azabicyclo[3.2.1]octane-7-carbothioamide CAS Name: N-[2,3-bis(2-pyridinyl)-6-quinoxalinyl]-3,3,5-trimethyl-7-azabicyclo[3.2.1]octane-7-carbothioamide IUPAC Name: N-(2,3-dipyridin-2-ylquinoxalin-6-yl)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octane-7-carbothioamide Traditional Name: N-[2,3-bis(2-pyridyl)quinoxalin-6-yl]-3,3,5-trimethyl-7-azabicyclo[3.2.1]octane-7-carbothioamide Formula: C29H30N6S MolecularWeight: 494.6537

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2CC(C1)(CN2C(=S)NC3=CC4=C(C=C3)N=C(C(=N4)C5=CC=CC=N5)C6=CC=CC=N6)C)C

Isomeric SMILES

CC1(CC2CC(C1)(CN2C(=S)NC3=CC4=C(C=C3)N=C(C(=N4)C5=CC=CC=N5)C6=CC=CC=N6)C)C

InChI

InChI=1S/C29H30N6S/c1-28(2)15-20-16-29(3,17-28)18-35(20)27(36)32-19-10-11-21-24(14-19)34-26(23-9-5-7-13-31-23)25(33-21)22-8-4-6-12-30-22/h4-14,20H,15-18H2,1-3H3,(H,32,36)