4-bromanyl-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide

Systemtic Name: 4-bromanyl-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: 4-bromo-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)benzamide CAS Name: 4-bromo-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: 4-bromo-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: 4-bromo-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)benzamide Formula: C23H26BrN3O2S MolecularWeight: 488.44044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(S2)N(CCCN3CCOCC3)C(=O)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(S2)N(CCCN3CCOCC3)C(=O)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C23H26BrN3O2S/c1-16-14-17(2)21-20(15-16)25-23(30-21)27(9-3-8-26-10-12-29-13-11-26)22(28)18-4-6-19(24)7-5-18/h4-7,14-15H,3,8-13H2,1-2H3