N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-(4-propan-2-ylsulfanylphenyl)ethanamide

Systemtic Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-(4-propan-2-ylsulfanylphenyl)ethanamide Openeye Name: 2-(4-isopropylsulfanylphenyl)-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)acetamide CAS Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]-2-[4-(propan-2-ylthio)phenyl]acetamide IUPAC Name: N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-(4-propan-2-ylsulfanylphenyl)acetamide Traditional Name: 2-[4-(isopropylthio)phenyl]-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)acetamide Formula: C26H33N3O3S2 MolecularWeight: 499.68852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)CC(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=CC(=C4)OC

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)CC(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=CC(=C4)OC

InChI

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