3-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]propanamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]propanamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]propanamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]propanamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]propionamide Formula: C22H26N2O3S MolecularWeight: 398.51844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)CCC2=NC3=CC=CC=C3S2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](C)NC(=O)CCC2=NC3=CC=CC=C3S2)OCC

InChI

InChI=1S/C22H26N2O3S/c1-4-26-18-11-10-16(14-19(18)27-5-2)15(3)23-21(25)12-13-22-24-17-8-6-7-9-20(17)28-22/h6-11,14-15H,4-5,12-13H2,1-3H3,(H,23,25)/t15-/m0/s1