N-[(4-ethoxy-2-methyl-5-propan-2-yl-phenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(4-ethoxy-2-methyl-5-propan-2-yl-phenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(4-ethoxy-5-isopropyl-2-methyl-phenyl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[(4-ethoxy-2-methyl-5-propan-2-ylphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(4-ethoxy-2-methyl-5-propan-2-ylphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(4-ethoxy-5-isopropyl-2-methyl-benzylidene)amino]-5-nitro-benzothiophene-2-carboxamide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])C(C)C

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C22H23N3O4S/c1-5-29-19-8-14(4)16(10-18(19)13(2)3)12-23-24-22(26)21-11-15-9-17(25(27)28)6-7-20(15)30-21/h6-13H,5H2,1-4H3,(H,24,26)