2-[4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-2-methoxy-phenoxy]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-2-methoxy-phenoxy]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]-2-methoxy-phenoxy]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-2-methoxyphenoxy]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-2-methoxyphenoxy]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]-2-methoxy-phenoxy]-1-pyrrolidino-ethanone Formula: C22H22N2O3S MolecularWeight: 394.48668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC2=NC3=CC=CC=C3S2)OCC(=O)N4CCCC4

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C2=NC3=CC=CC=C3S2)OCC(=O)N4CCCC4

InChI

InChI=1S/C22H22N2O3S/c1-26-19-14-16(9-11-21-23-17-6-2-3-7-20(17)28-21)8-10-18(19)27-15-22(25)24-12-4-5-13-24/h2-3,6-11,14H,4-5,12-13,15H2,1H3/b11-9+