4-chloranyl-N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-3-(methylaminomethyl)benzamide

Systemtic Name: 4-chloranyl-N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-3-(methylaminomethyl)benzamide Openeye Name: 4-chloro-N-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)-3-(methylaminomethyl)benzamide CAS Name: 4-chloro-N-[4-methoxy-7-(4-morpholinyl)-1,3-benzothiazol-2-yl]-3-(methylaminomethyl)benzamide IUPAC Name: 4-chloro-N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-3-(methylaminomethyl)benzamide Traditional Name: 4-chloro-N-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)-3-(methylaminomethyl)benzamide Formula: C21H23ClN4O3S MolecularWeight: 446.95032

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=C(C=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)N4CCOCC4)OC)Cl

Isomeric SMILES

CNCC1=C(C=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)N4CCOCC4)OC)Cl

InChI

InChI=1S/C21H23ClN4O3S/c1-23-12-14-11-13(3-4-15(14)22)20(27)25-21-24-18-17(28-2)6-5-16(19(18)30-21)26-7-9-29-10-8-26/h3-6,11,23H,7-10,12H2,1-2H3,(H,24,25,27)