N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]ethanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]ethanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]acetamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-[(3,4-dimethoxyphenyl)methyl-methylamino]acetamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-[(3,4-dimethoxyphenyl)methyl-methylamino]acetamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-[methyl(veratryl)amino]acetamide Formula: C21H25N3O3S MolecularWeight: 399.5065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)CC(=O)NCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)CC(=O)NCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H25N3O3S/c1-24(13-15-8-9-17(26-2)18(12-15)27-3)14-20(25)22-11-10-21-23-16-6-4-5-7-19(16)28-21/h4-9,12H,10-11,13-14H2,1-3H3,(H,22,25)