(2-ethylsulfanylbenzimidazol-1-yl)-[5-(4-methoxy-2-nitro-phenyl)furan-2-yl]methanone

Systemtic Name: (2-ethylsulfanylbenzimidazol-1-yl)-[5-(4-methoxy-2-nitro-phenyl)furan-2-yl]methanone Openeye Name: (2-ethylsulfanylbenzimidazol-1-yl)-[5-(4-methoxy-2-nitro-phenyl)-2-furyl]methanone CAS Name: [2-(ethylthio)-1-benzimidazolyl]-[5-(4-methoxy-2-nitrophenyl)-2-furanyl]methanone IUPAC Name: (2-ethylsulfanylbenzimidazol-1-yl)-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]methanone Traditional Name: [2-(ethylthio)benzimidazol-1-yl]-[5-(4-methoxy-2-nitro-phenyl)-2-furyl]methanone Formula: C21H17N3O5S MolecularWeight: 423.44178

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=CC=CC=C2N1C(=O)C3=CC=C(O3)C4=C(C=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CCSC1=NC2=CC=CC=C2N1C(=O)C3=CC=C(O3)C4=C(C=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O5S/c1-3-30-21-22-15-6-4-5-7-16(15)23(21)20(25)19-11-10-18(29-19)14-9-8-13(28-2)12-17(14)24(26)27/h4-12H,3H2,1-2H3