N-(4-ethyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-N-(2-morpholin-4-ylethyl)propanamide

Systemtic Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-N-(2-morpholin-4-ylethyl)propanamide Openeye Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-3-[(4-methylphenyl)thio]-N-[2-(4-morpholinyl)ethyl]propanamide IUPAC Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)sulfanyl-N-(2-morpholin-4-ylethyl)propanamide Traditional Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-3-(p-tolylthio)propionamide Formula: C25H31N3O2S2 MolecularWeight: 469.66254

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CCN3CCOCC3)C(=O)CCSC4=CC=C(C=C4)C

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CCN3CCOCC3)C(=O)CCSC4=CC=C(C=C4)C

InChI

InChI=1S/C25H31N3O2S2/c1-3-20-5-4-6-22-24(20)26-25(32-22)28(13-12-27-14-16-30-17-15-27)23(29)11-18-31-21-9-7-19(2)8-10-21/h4-10H,3,11-18H2,1-2H3