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

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-3-chloranyl-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-chloro-N-(3-morpholinopropyl)benzamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-chloro-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-chloro-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-chloro-N-(3-morpholinopropyl)benzamide Formula: C21H21BrClN3O2S MolecularWeight: 494.83234

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN(C2=NC3=C(S2)C=C(C=C3)Br)C(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1COCCN1CCCN(C2=NC3=C(S2)C=C(C=C3)Br)C(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H21BrClN3O2S/c22-16-5-6-18-19(14-16)29-21(24-18)26(8-2-7-25-9-11-28-12-10-25)20(27)15-3-1-4-17(23)13-15/h1,3-6,13-14H,2,7-12H2