N-[[4-(2-methylpropoxy)phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[4-(2-methylpropoxy)phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(4-isobutoxyphenyl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[[4-(2-methylpropoxy)phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[4-(2-methylpropoxy)phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(4-isobutoxybenzylidene)amino]-5-nitro-benzothiophene-2-carboxamide Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O4S/c1-13(2)12-27-17-6-3-14(4-7-17)11-21-22-20(24)19-10-15-9-16(23(25)26)5-8-18(15)28-19/h3-11,13H,12H2,1-2H3,(H,22,24)