2-(3-bromanyl-1-adamantyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide Formula: C26H27BrN2OS MolecularWeight: 495.47438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CC45CC6CC(C4)CC(C6)(C5)Br

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CC45CC6CC(C4)CC(C6)(C5)Br

InChI

InChI=1S/C26H27BrN2OS/c1-16-2-7-21-22(8-16)31-24(29-21)19-3-5-20(6-4-19)28-23(30)14-25-10-17-9-18(11-25)13-26(27,12-17)15-25/h2-8,17-18H,9-15H2,1H3,(H,28,30)