N-[[5-(diethylamino)-4-(2-nitrophenyl)sulfanyl-furan-2-yl]methylideneamino]-4-nitro-benzamide

Systemtic Name: N-[[5-(diethylamino)-4-(2-nitrophenyl)sulfanyl-furan-2-yl]methylideneamino]-4-nitro-benzamide Openeye Name: N-[[5-(diethylamino)-4-(2-nitrophenyl)sulfanyl-2-furyl]methyleneamino]-4-nitro-benzamide CAS Name: N-[[5-(diethylamino)-4-[(2-nitrophenyl)thio]-2-furanyl]methylideneamino]-4-nitrobenzamide IUPAC Name: N-[[5-(diethylamino)-4-(2-nitrophenyl)sulfanylfuran-2-yl]methylideneamino]-4-nitrobenzamide Traditional Name: N-[[5-(diethylamino)-4-[(2-nitrophenyl)thio]-2-furyl]methyleneamino]-4-nitro-benzamide Formula: C22H21N5O6S MolecularWeight: 483.49704

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(O1)C=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])SC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=C(C=C(O1)C=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])SC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O6S/c1-3-25(4-2)22-20(34-19-8-6-5-7-18(19)27(31)32)13-17(33-22)14-23-24-21(28)15-9-11-16(12-10-15)26(29)30/h5-14H,3-4H2,1-2H3,(H,24,28)