N-[(3-bromanyl-5-chloranyl-4-methoxy-phenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(3-bromanyl-5-chloranyl-4-methoxy-phenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(3-bromo-5-chloro-4-methoxy-phenyl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[(3-bromo-5-chloro-4-methoxyphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(3-bromo-5-chloro-4-methoxyphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(3-bromo-5-chloro-4-methoxy-benzylidene)amino]-5-nitro-benzothiophene-2-carboxamide Formula: C17H11BrClN3O4S MolecularWeight: 468.70894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Br)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C(C=C1Br)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H11BrClN3O4S/c1-26-16-12(18)4-9(5-13(16)19)8-20-21-17(23)15-7-10-6-11(22(24)25)2-3-14(10)27-15/h2-8H,1H3,(H,21,23)