N-(6-bromanyl-1,3-benzothiazol-2-yl)-3-phenyl-adamantane-1-carboxamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-3-phenyl-adamantane-1-carboxamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenyl-adamantane-1-carboxamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenyl-1-adamantanecarboxamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenyladamantane-1-carboxamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-phenyl-adamantane-1-carboxamide Formula: C24H23BrN2OS MolecularWeight: 467.42122

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)C(=O)NC4=NC5=C(S4)C=C(C=C5)Br)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)C(=O)NC4=NC5=C(S4)C=C(C=C5)Br)C6=CC=CC=C6

InChI

InChI=1S/C24H23BrN2OS/c25-18-6-7-19-20(9-18)29-22(26-19)27-21(28)24-12-15-8-16(13-24)11-23(10-15,14-24)17-4-2-1-3-5-17/h1-7,9,15-16H,8,10-14H2,(H,26,27,28)