5-methyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-thiophene-3-carboxamide

Systemtic Name: 5-methyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-thiophene-3-carboxamide Openeye Name: 5-methyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-phenyl-thiophene-3-carboxamide CAS Name: 5-methyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-3-thiophenecarboxamide IUPAC Name: 5-methyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenylthiophene-3-carboxamide Traditional Name: 5-methyl-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-phenyl-thiophene-3-carboxamide Formula: C20H15N3O5S MolecularWeight: 409.4152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CS1)C(=O)NN=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CS1)C(=O)N/N=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C4=CC=CC=C4

InChI

InChI=1S/C20H15N3O5S/c1-12-19(13-5-3-2-4-6-13)15(10-29-12)20(24)22-21-9-14-7-17-18(28-11-27-17)8-16(14)23(25)26/h2-10H,11H2,1H3,(H,22,24)/b21-9+