N-[1-(1,3-benzothiazol-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]-4-tert-butyl-benzamide

Systemtic Name: N-[1-(1,3-benzothiazol-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]-4-tert-butyl-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-ylmethylamino)-1-methyl-2-oxo-ethyl]-4-tert-butyl-benzamide CAS Name: N-[1-(1,3-benzothiazol-2-ylmethylamino)-1-oxopropan-2-yl]-4-tert-butylbenzamide IUPAC Name: N-[1-(1,3-benzothiazol-2-ylmethylamino)-1-oxopropan-2-yl]-4-tert-butylbenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-ylmethylamino)-2-keto-1-methyl-ethyl]-4-tert-butyl-benzamide Formula: C22H25N3O2S MolecularWeight: 395.5178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=NC2=CC=CC=C2S1)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C(=O)NCC1=NC2=CC=CC=C2S1)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H25N3O2S/c1-14(24-21(27)15-9-11-16(12-10-15)22(2,3)4)20(26)23-13-19-25-17-7-5-6-8-18(17)28-19/h5-12,14H,13H2,1-4H3,(H,23,26)(H,24,27)