5-methoxy-3-propan-2-yloxy-N-(3-pyridin-4-ylsulfanylpropyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-methoxy-3-propan-2-yloxy-N-(3-pyridin-4-ylsulfanylpropyl)-1-benzothiophene-2-carboxamide Openeye Name: 3-isopropoxy-5-methoxy-N-[3-(4-pyridylsulfanyl)propyl]benzothiophene-2-carboxamide CAS Name: 5-methoxy-3-propan-2-yloxy-N-[3-(pyridin-4-ylthio)propyl]-1-benzothiophene-2-carboxamide IUPAC Name: 5-methoxy-3-propan-2-yloxy-N-(3-pyridin-4-ylsulfanylpropyl)-1-benzothiophene-2-carboxamide Traditional Name: 3-isopropoxy-5-methoxy-N-[3-(4-pyridylthio)propyl]benzothiophene-2-carboxamide Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(SC2=C1C=C(C=C2)OC)C(=O)NCCCSC3=CC=NC=C3

Isomeric SMILES

CC(C)OC1=C(SC2=C1C=C(C=C2)OC)C(=O)NCCCSC3=CC=NC=C3

InChI

InChI=1S/C21H24N2O3S2/c1-14(2)26-19-17-13-15(25-3)5-6-18(17)28-20(19)21(24)23-9-4-12-27-16-7-10-22-11-8-16/h5-8,10-11,13-14H,4,9,12H2,1-3H3,(H,23,24)