N-[(E)-(4-butoxy-3-ethoxy-phenyl)methylideneamino]-3-chloranyl-6-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(E)-(4-butoxy-3-ethoxy-phenyl)methylideneamino]-3-chloranyl-6-methyl-1-benzothiophene-2-carboxamide Openeye Name: N-[(E)-(4-butoxy-3-ethoxy-phenyl)methyleneamino]-3-chloro-6-methyl-benzothiophene-2-carboxamide CAS Name: N-[(E)-(4-butoxy-3-ethoxyphenyl)methylideneamino]-3-chloro-6-methyl-1-benzothiophene-2-carboxamide IUPAC Name: N-[(E)-(4-butoxy-3-ethoxyphenyl)methylideneamino]-3-chloro-6-methyl-1-benzothiophene-2-carboxamide Traditional Name: N-[(E)-(4-butoxy-3-ethoxy-benzylidene)amino]-3-chloro-6-methyl-benzothiophene-2-carboxamide Formula: C23H25ClN2O3S MolecularWeight: 444.9742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=NNC(=O)C2=C(C3=C(S2)C=C(C=C3)C)Cl)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=N/NC(=O)C2=C(C3=C(S2)C=C(C=C3)C)Cl)OCC

InChI

InChI=1S/C23H25ClN2O3S/c1-4-6-11-29-18-10-8-16(13-19(18)28-5-2)14-25-26-23(27)22-21(24)17-9-7-15(3)12-20(17)30-22/h7-10,12-14H,4-6,11H2,1-3H3,(H,26,27)/b25-14+