N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-nitro-benzamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-nitro-benzamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-4-nitro-benzamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-4-nitrobenzamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-nitrobenzamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-4-nitro-benzamide Formula: C19H12BrN3O4S MolecularWeight: 458.28528

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN(C2=NC3=C(S2)C=C(C=C3)Br)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)CN(C2=NC3=C(S2)C=C(C=C3)Br)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H12BrN3O4S/c20-13-5-8-16-17(10-13)28-19(21-16)22(11-15-2-1-9-27-15)18(24)12-3-6-14(7-4-12)23(25)26/h1-10H,11H2