N-(1,3-benzodioxol-4-ylmethyl)-N-(pyridin-3-ylmethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(pyridin-3-ylmethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(3-pyridylmethyl)benzothiophene-2-carboxamide CAS Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(3-pyridinylmethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(pyridin-3-ylmethyl)-1-benzothiophene-2-carboxamide Traditional Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(3-pyridylmethyl)benzothiophene-2-carboxamide Formula: C23H18N2O3S MolecularWeight: 402.46562

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=CC=CC(=C2O1)CN(CC3=CN=CC=C3)C(=O)C4=CC5=CC=CC=C5S4

Isomeric SMILES

C1OC2=CC=CC(=C2O1)CN(CC3=CN=CC=C3)C(=O)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C23H18N2O3S/c26-23(21-11-17-6-1-2-9-20(17)29-21)25(13-16-5-4-10-24-12-16)14-18-7-3-8-19-22(18)28-15-27-19/h1-12H,13-15H2