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

Systemtic Name: 2-[1-adamantyl(methyl)amino]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]ethanamide Openeye Name: 2-[1-adamantyl(methyl)amino]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide CAS Name: 2-[1-adamantyl(methyl)amino]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide IUPAC Name: 2-[1-adamantyl(methyl)amino]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide Traditional Name: 2-[1-adamantyl(methyl)amino]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide Formula: C27H31N3OS MolecularWeight: 445.61954

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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)CN(C)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CN(C)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H31N3OS/c1-17-3-8-23-24(9-17)32-26(29-23)21-4-6-22(7-5-21)28-25(31)16-30(2)27-13-18-10-19(14-27)12-20(11-18)15-27/h3-9,18-20H,10-16H2,1-2H3,(H,28,31)