N-[(4-tert-butylphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(4-tert-butylphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(4-tert-butylphenyl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[(4-tert-butylphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(4-tert-butylphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(4-tert-butylbenzylidene)amino]-5-nitro-benzothiophene-2-carboxamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O3S/c1-20(2,3)15-6-4-13(5-7-15)12-21-22-19(24)18-11-14-10-16(23(25)26)8-9-17(14)27-18/h4-12H,1-3H3,(H,22,24)