N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)propanamide

Systemtic Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)propanamide Openeye Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-N-(3-morpholinopropyl)propanamide CAS Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3-[(4-methoxyphenyl)thio]-N-[3-(4-morpholinyl)propyl]propanamide IUPAC Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)propanamide Traditional Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3-[(4-methoxyphenyl)thio]-N-(3-morpholinopropyl)propionamide Formula: C26H33N3O3S2 MolecularWeight: 499.68852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)N(CCCN3CCOCC3)C(=O)CCSC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)N(CCCN3CCOCC3)C(=O)CCSC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H33N3O3S2/c1-19-5-6-20(2)25-24(19)27-26(34-25)29(13-4-12-28-14-16-32-17-15-28)23(30)11-18-33-22-9-7-21(31-3)8-10-22/h5-10H,4,11-18H2,1-3H3