N-[[3,5-bis(chloranyl)-4-ethoxy-phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[3,5-bis(chloranyl)-4-ethoxy-phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[(3,5-dichloro-4-ethoxy-phenyl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[(3,5-dichloro-4-ethoxyphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(3,5-dichloro-4-ethoxyphenyl)methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[(3,5-dichloro-4-ethoxy-benzylidene)amino]-5-nitro-benzothiophene-2-carboxamide Formula: C18H13Cl2N3O4S MolecularWeight: 438.28452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H13Cl2N3O4S/c1-2-27-17-13(19)5-10(6-14(17)20)9-21-22-18(24)16-8-11-7-12(23(25)26)3-4-15(11)28-16/h3-9H,2H2,1H3,(H,22,24)