N-(6-bromanyl-1,3-benzothiazol-2-yl)-5-methyl-N-(3-morpholin-4-ylpropyl)-1-propan-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-5-methyl-N-(3-morpholin-4-ylpropyl)-1-propan-2-yl-pyrazole-3-carboxamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-isopropyl-5-methyl-N-(3-morpholinopropyl)pyrazole-3-carboxamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-5-methyl-N-[3-(4-morpholinyl)propyl]-1-propan-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-5-methyl-N-(3-morpholin-4-ylpropyl)-1-propan-2-ylpyrazole-3-carboxamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-isopropyl-5-methyl-N-(3-morpholinopropyl)pyrazole-3-carboxamide Formula: C22H28BrN5O2S MolecularWeight: 506.45902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C)C)C(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=C(C=C4)Br

Isomeric SMILES

CC1=CC(=NN1C(C)C)C(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=C(C=C4)Br

InChI

InChI=1S/C22H28BrN5O2S/c1-15(2)28-16(3)13-19(25-28)21(29)27(8-4-7-26-9-11-30-12-10-26)22-24-18-6-5-17(23)14-20(18)31-22/h5-6,13-15H,4,7-12H2,1-3H3