N-(2,5-dimethylphenyl)-N'-[(E)-(5-nitrothiophen-2-yl)methylideneamino]butanediamide

Systemtic Name: N-(2,5-dimethylphenyl)-N'-[(E)-(5-nitrothiophen-2-yl)methylideneamino]butanediamide Openeye Name: N-(2,5-dimethylphenyl)-N'-[(E)-(5-nitro-2-thienyl)methyleneamino]butanediamide CAS Name: N-(2,5-dimethylphenyl)-N'-[(E)-(5-nitro-2-thiophenyl)methylideneamino]butanediamide IUPAC Name: N-(2,5-dimethylphenyl)-N'-[(E)-(5-nitrothiophen-2-yl)methylideneamino]butanediamide Traditional Name: N-(2,5-dimethylphenyl)-N'-[(E)-(5-nitro-2-thienyl)methyleneamino]succinamide Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CCC(=O)NN=CC2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CCC(=O)N/N=C/C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O4S/c1-11-3-4-12(2)14(9-11)19-15(22)6-7-16(23)20-18-10-13-5-8-17(26-13)21(24)25/h3-5,8-10H,6-7H2,1-2H3,(H,19,22)(H,20,23)/b18-10+