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

Systemtic Name: (2S)-2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N-ethyl-N-(phenylmethyl)propanamide Openeye Name: (2S)-2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N-benzyl-N-ethyl-propanamide CAS Name: (2S)-2-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-N-ethyl-N-(phenylmethyl)propanamide IUPAC Name: (2S)-2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N-benzyl-N-ethylpropanamide Traditional Name: (2S)-2-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]-N-benzyl-N-ethyl-propionamide Formula: C24H30N4OS MolecularWeight: 422.5862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C(C)N2CCN(CC2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)[C@H](C)N2CCN(CC2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H30N4OS/c1-3-27(17-20-9-5-4-6-10-20)24(29)19(2)28-15-13-26(14-16-28)18-23-25-21-11-7-8-12-22(21)30-23/h4-12,19H,3,13-18H2,1-2H3/t19-/m0/s1