N-(2-methyl-1,3-benzothiazol-5-yl)-1-phenyl-5-propyl-pyrazole-4-carboxamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-5-yl)-1-phenyl-5-propyl-pyrazole-4-carboxamide Openeye Name: N-(2-methyl-1,3-benzothiazol-5-yl)-1-phenyl-5-propyl-pyrazole-4-carboxamide CAS Name: N-(2-methyl-1,3-benzothiazol-5-yl)-1-phenyl-5-propyl-4-pyrazolecarboxamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-5-yl)-1-phenyl-5-propylpyrazole-4-carboxamide Traditional Name: N-(2-methyl-1,3-benzothiazol-5-yl)-1-phenyl-5-propyl-pyrazole-4-carboxamide Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)SC(=N4)C

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)SC(=N4)C

InChI

InChI=1S/C21H20N4OS/c1-3-7-19-17(13-22-25(19)16-8-5-4-6-9-16)21(26)24-15-10-11-20-18(12-15)23-14(2)27-20/h4-6,8-13H,3,7H2,1-2H3,(H,24,26)