N-(6-butyl-1,3-benzothiazol-2-yl)-5-(2-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-(6-butyl-1,3-benzothiazol-2-yl)-5-(2-nitrophenyl)furan-2-carboxamide Openeye Name: N-(6-butyl-1,3-benzothiazol-2-yl)-5-(2-nitrophenyl)furan-2-carboxamide CAS Name: N-(6-butyl-1,3-benzothiazol-2-yl)-5-(2-nitrophenyl)-2-furancarboxamide IUPAC Name: N-(6-butyl-1,3-benzothiazol-2-yl)-5-(2-nitrophenyl)furan-2-carboxamide Traditional Name: N-(6-butyl-1,3-benzothiazol-2-yl)-5-(2-nitrophenyl)-2-furamide Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O4S/c1-2-3-6-14-9-10-16-20(13-14)30-22(23-16)24-21(26)19-12-11-18(29-19)15-7-4-5-8-17(15)25(27)28/h4-5,7-13H,2-3,6H2,1H3,(H,23,24,26)