N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-(phenylsulfonyl)ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)-2-(phenylsulfonyl)ethanamide Openeye Name: 2-(benzenesulfonyl)-N-(1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)acetamide CAS Name: 2-(benzenesulfonyl)-N-(1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]acetamide IUPAC Name: 2-(benzenesulfonyl)-N-(1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-besyl-N-(3-morpholinopropyl)acetamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN(C2=NC3=CC=CC=C3S2)C(=O)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1CCCN(C2=NC3=CC=CC=C3S2)C(=O)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H25N3O4S2/c26-21(17-31(27,28)18-7-2-1-3-8-18)25(12-6-11-24-13-15-29-16-14-24)22-23-19-9-4-5-10-20(19)30-22/h1-5,7-10H,6,11-17H2