5-bromanyl-N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]thiophene-2-carboxamide

Systemtic Name: 5-bromanyl-N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]thiophene-2-carboxamide Openeye Name: 5-bromo-N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]thiophene-2-carboxamide CAS Name: 5-bromo-N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]-2-thiophenecarboxamide IUPAC Name: 5-bromo-N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]thiophene-2-carboxamide Traditional Name: 5-bromo-N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]thiophene-2-carboxamide Formula: C18H15BrN4OS2 MolecularWeight: 447.3719

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)C4=CC=C(S4)Br)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)C4=CC=C(S4)Br)C

InChI

InChI=1S/C18H15BrN4OS2/c1-9-6-10(2)16-13(7-9)26-18(21-16)23-15(8-11(3)22-23)20-17(24)12-4-5-14(19)25-12/h4-8H,1-3H3,(H,20,24)