(2S)-N-(1,3-benzothiazol-2-yl)-2-(4-ethanoylphenoxy)-N-(3-ethylphenyl)propanamide

Systemtic Name: (2S)-N-(1,3-benzothiazol-2-yl)-2-(4-ethanoylphenoxy)-N-(3-ethylphenyl)propanamide Openeye Name: (2S)-2-(4-acetylphenoxy)-N-(1,3-benzothiazol-2-yl)-N-(3-ethylphenyl)propanamide CAS Name: (2S)-2-(4-acetylphenoxy)-N-(1,3-benzothiazol-2-yl)-N-(3-ethylphenyl)propanamide IUPAC Name: (2S)-2-(4-acetylphenoxy)-N-(1,3-benzothiazol-2-yl)-N-(3-ethylphenyl)propanamide Traditional Name: (2S)-2-(4-acetylphenoxy)-N-(1,3-benzothiazol-2-yl)-N-(3-ethylphenyl)propionamide Formula: C26H24N2O3S MolecularWeight: 444.54536

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C(C)OC4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CCC1=CC(=CC=C1)N(C2=NC3=CC=CC=C3S2)C(=O)[C@H](C)OC4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C26H24N2O3S/c1-4-19-8-7-9-21(16-19)28(26-27-23-10-5-6-11-24(23)32-26)25(30)18(3)31-22-14-12-20(13-15-22)17(2)29/h5-16,18H,4H2,1-3H3/t18-/m0/s1