4-chloranyl-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)benzamide

Systemtic Name: 4-chloranyl-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)benzamide Openeye Name: 4-chloro-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)benzamide CAS Name: 4-chloro-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]benzamide IUPAC Name: 4-chloro-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: 4-chloro-N-(5-methoxy-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)benzamide Formula: C21H22ClN3O3S MolecularWeight: 431.93568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=N2)N(CCN3CCOCC3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=N2)N(CCN3CCOCC3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O3S/c1-27-17-6-7-19-18(14-17)23-21(29-19)25(9-8-24-10-12-28-13-11-24)20(26)15-2-4-16(22)5-3-15/h2-7,14H,8-13H2,1H3