N-(1,3-benzothiazol-2-yl)-3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-(4-bromo-3,5-dimethylpyrazol-1-yl)propanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propionamide Formula: C15H15BrN4OS MolecularWeight: 379.2748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NC2=NC3=CC=CC=C3S2)C)Br

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NC2=NC3=CC=CC=C3S2)C)Br

InChI

InChI=1S/C15H15BrN4OS/c1-9-14(16)10(2)20(19-9)8-7-13(21)18-15-17-11-5-3-4-6-12(11)22-15/h3-6H,7-8H2,1-2H3,(H,17,18,21)