N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-3-phenylsulfanyl-propanamide

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-3-phenylsulfanyl-propanamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-3-phenylsulfanyl-propanamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-3-(phenylthio)propanamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-3-phenylsulfanylpropanamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-3-(phenylthio)propionamide Formula: C24H29N3O2S2 MolecularWeight: 455.63596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CCN3CCOCC3)C(=O)CCSC4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CCN3CCOCC3)C(=O)CCSC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O2S2/c1-2-19-8-9-21-22(18-19)31-24(25-21)27(12-11-26-13-15-29-16-14-26)23(28)10-17-30-20-6-4-3-5-7-20/h3-9,18H,2,10-17H2,1H3