3-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 3-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide Openeye Name: 3-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide CAS Name: 3-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 3-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide Traditional Name: 3-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)benzamide Formula: C19H14BrN5O4S MolecularWeight: 488.31456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)CN4C=C(C(=N4)[N+](=O)[O-])Br

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)CN4C=C(C(=N4)[N+](=O)[O-])Br

InChI

InChI=1S/C19H14BrN5O4S/c1-29-13-5-6-15-16(8-13)30-19(21-15)22-18(26)12-4-2-3-11(7-12)9-24-10-14(20)17(23-24)25(27)28/h2-8,10H,9H2,1H3,(H,21,22,26)