2-[4-(1,3-benzothiazol-2-yl)-2-(dimethylaminomethyl)phenoxy]-N-ethyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(1,3-benzothiazol-2-yl)-2-(dimethylaminomethyl)phenoxy]-N-ethyl-N-(phenylmethyl)ethanamide Openeye Name: 2-[4-(1,3-benzothiazol-2-yl)-2-(dimethylaminomethyl)phenoxy]-N-benzyl-N-ethyl-acetamide CAS Name: 2-[4-(1,3-benzothiazol-2-yl)-2-(dimethylaminomethyl)phenoxy]-N-ethyl-N-(phenylmethyl)acetamide IUPAC Name: 2-[4-(1,3-benzothiazol-2-yl)-2-(dimethylaminomethyl)phenoxy]-N-benzyl-N-ethylacetamide Traditional Name: 2-[4-(1,3-benzothiazol-2-yl)-2-(dimethylaminomethyl)phenoxy]-N-benzyl-N-ethyl-acetamide Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)COC2=C(C=C(C=C2)C3=NC4=CC=CC=C4S3)CN(C)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)COC2=C(C=C(C=C2)C3=NC4=CC=CC=C4S3)CN(C)C

InChI

InChI=1S/C27H29N3O2S/c1-4-30(17-20-10-6-5-7-11-20)26(31)19-32-24-15-14-21(16-22(24)18-29(2)3)27-28-23-12-8-9-13-25(23)33-27/h5-16H,4,17-19H2,1-3H3