N'-[4-[2-[(2,4-dimethoxy-6-oxidanyl-phenyl)methylamino]ethyl]phenyl]thiophene-2-carboximidamide

Systemtic Name: N'-[4-[2-[(2,4-dimethoxy-6-oxidanyl-phenyl)methylamino]ethyl]phenyl]thiophene-2-carboximidamide Openeye Name: N'-[4-[2-[(2-hydroxy-4,6-dimethoxy-phenyl)methylamino]ethyl]phenyl]thiophene-2-carboxamidine CAS Name: N'-[4-[2-[(2-hydroxy-4,6-dimethoxyphenyl)methylamino]ethyl]phenyl]-2-thiophenecarboximidamide IUPAC Name: N'-[4-[2-[(2-hydroxy-4,6-dimethoxyphenyl)methylamino]ethyl]phenyl]thiophene-2-carboximidamide Traditional Name: N'-[4-[2-[(2-hydroxy-4,6-dimethoxy-benzyl)amino]ethyl]phenyl]thiophene-2-carboxamidine Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)CNCCC2=CC=C(C=C2)N=C(C3=CC=CS3)N)O

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)CNCCC2=CC=C(C=C2)N=C(C3=CC=CS3)N)O

InChI

InChI=1S/C22H25N3O3S/c1-27-17-12-19(26)18(20(13-17)28-2)14-24-10-9-15-5-7-16(8-6-15)25-22(23)21-4-3-11-29-21/h3-8,11-13,24,26H,9-10,14H2,1-2H3,(H2,23,25)