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

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-furamide Formula: C17H12BrN5O4S MolecularWeight: 462.27728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br

InChI

InChI=1S/C17H12BrN5O4S/c1-9-2-4-12-14(6-9)28-17(19-12)20-16(24)13-5-3-10(27-13)7-22-8-11(18)15(21-22)23(25)26/h2-6,8H,7H2,1H3,(H,19,20,24)