3-(4-tert-butylphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(4-tert-butylphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(4-tert-butylphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(4-tert-butylphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(4-tert-butylphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(4-tert-butylphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)propionamide Formula: C21H24N2OS MolecularWeight: 352.49306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H24N2OS/c1-14-5-11-17-18(13-14)25-20(22-17)23-19(24)12-8-15-6-9-16(10-7-15)21(2,3)4/h5-7,9-11,13H,8,12H2,1-4H3,(H,22,23,24)