N-(1,3-benzothiazol-2-yl)-1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]pyrazole-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]pyrazole-3-carboxamide Formula: C17H15BrN6OS MolecularWeight: 431.3096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=NC4=CC=CC=C4S3)C)Br

Isomeric SMILES

CC1=C(C(=NN1CN2C=CC(=N2)C(=O)NC3=NC4=CC=CC=C4S3)C)Br

InChI

InChI=1S/C17H15BrN6OS/c1-10-15(18)11(2)24(21-10)9-23-8-7-13(22-23)16(25)20-17-19-12-5-3-4-6-14(12)26-17/h3-8H,9H2,1-2H3,(H,19,20,25)