N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-N-(2-dimethylaminoethyl)-1-propan-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-N-(2-dimethylaminoethyl)-1-propan-2-yl-pyrazole-3-carboxamide Openeye Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-1-isopropyl-pyrazole-3-carboxamide CAS Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-1-propan-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-1-propan-2-ylpyrazole-3-carboxamide Traditional Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-1-isopropyl-pyrazole-3-carboxamide Formula: C18H21F2N5OS MolecularWeight: 393.454046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=CC(=N1)C(=O)N(CCN(C)C)C2=NC3=C(C=C(C=C3S2)F)F

Isomeric SMILES

CC(C)N1C=CC(=N1)C(=O)N(CCN(C)C)C2=NC3=C(C=C(C=C3S2)F)F

InChI

InChI=1S/C18H21F2N5OS/c1-11(2)25-6-5-14(22-25)17(26)24(8-7-23(3)4)18-21-16-13(20)9-12(19)10-15(16)27-18/h5-6,9-11H,7-8H2,1-4H3