N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-5-nitro-furan-2-carboxamide

Systemtic Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-5-nitro-furan-2-carboxamide Openeye Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-5-nitro-furan-2-carboxamide CAS Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-5-nitro-2-furancarboxamide IUPAC Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-5-nitrofuran-2-carboxamide Traditional Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-5-nitro-2-furamide Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=NC(=O)C3=CC=C(O3)[N+](=O)[O-])N2CC

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=NC(=O)C3=CC=C(O3)[N+](=O)[O-])N2CC

InChI

InChI=1S/C16H15N3O4S/c1-3-10-6-5-7-12-14(10)18(4-2)16(24-12)17-15(20)11-8-9-13(23-11)19(21)22/h5-9H,3-4H2,1-2H3