2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(2-methyl-6-propan-2-yl-phenyl)ethanamide; ethanedioic acid

Systemtic Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(2-methyl-6-propan-2-yl-phenyl)ethanamide; ethanedioic acid Openeye Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(2-isopropyl-6-methyl-phenyl)acetamide; oxalic acid CAS Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide; oxalic acid IUPAC Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide; oxalic acid Traditional Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(2-isopropyl-6-methyl-phenyl)acetamide; oxalic acid Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)CN(C)CC2=NC3=CC=CC=C3S2.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)CN(C)CC2=NC3=CC=CC=C3S2.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H25N3OS.C2H2O4/c1-14(2)16-9-7-8-15(3)21(16)23-19(25)12-24(4)13-20-22-17-10-5-6-11-18(17)26-20;3-1(4)2(5)6/h5-11,14H,12-13H2,1-4H3,(H,23,25);(H,3,4)(H,5,6)