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

Systemtic Name: N-[[4-[(2-cyanophenyl)methoxy]-3-methoxy-phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[[4-[(2-cyanophenyl)methoxy]-3-methoxy-phenyl]methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[[4-[(2-cyanophenyl)methoxy]-3-methoxyphenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[4-[(2-cyanophenyl)methoxy]-3-methoxyphenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[[4-(2-cyanobenzyl)oxy-3-methoxy-benzylidene]amino]-5-nitro-benzothiophene-2-carboxamide Formula: C25H18N4O5S MolecularWeight: 486.49922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OCC4=CC=CC=C4C#N

Isomeric SMILES

COC1=C(C=CC(=C1)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OCC4=CC=CC=C4C#N

InChI

InChI=1S/C25H18N4O5S/c1-33-22-10-16(6-8-21(22)34-15-18-5-3-2-4-17(18)13-26)14-27-28-25(30)24-12-19-11-20(29(31)32)7-9-23(19)35-24/h2-12,14H,15H2,1H3,(H,28,30)