3-bromanyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide

Systemtic Name: 3-bromanyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: 3-bromo-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)benzamide CAS Name: 3-bromo-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: 3-bromo-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: 3-bromo-N-(4,6-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)SC(=N2)N(CCCN3CCOCC3)C(=O)C4=CC(=CC=C4)Br)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N(CCCN3CCOCC3)C(=O)C4=CC(=CC=C4)Br)C

InChI

InChI=1S/C23H26BrN3O2S/c1-16-13-17(2)21-20(14-16)30-23(25-21)27(8-4-7-26-9-11-29-12-10-26)22(28)18-5-3-6-19(24)15-18/h3,5-6,13-15H,4,7-12H2,1-2H3