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

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-nitro-benzamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-3-nitro-benzamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-3-nitrobenzamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-3-nitrobenzamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-3-nitro-benzamide Formula: C21H17N3O5S MolecularWeight: 423.44178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CO3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CO3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O5S/c1-2-28-16-8-9-18-19(12-16)30-21(22-18)23(13-17-7-4-10-29-17)20(25)14-5-3-6-15(11-14)24(26)27/h3-12H,2,13H2,1H3