N-benzo[e][1,3]benzothiazol-2-yl-3-chloranyl-adamantane-1-carboxamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-3-chloranyl-adamantane-1-carboxamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-3-chloro-adamantane-1-carboxamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-3-chloro-1-adamantanecarboxamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-3-chloroadamantane-1-carboxamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-3-chloro-adamantane-1-carboxamide Formula: C22H21ClN2OS MolecularWeight: 396.93294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)NC4=NC5=C(S4)C=CC6=CC=CC=C65

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)NC4=NC5=C(S4)C=CC6=CC=CC=C65

InChI

InChI=1S/C22H21ClN2OS/c23-22-10-13-7-14(11-22)9-21(8-13,12-22)19(26)25-20-24-18-16-4-2-1-3-15(16)5-6-17(18)27-20/h1-6,13-14H,7-12H2,(H,24,25,26)