N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide

Systemtic Name: N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Openeye Name: N-[4-methoxy-3-(4-pyridylmethoxy)phenyl]-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide CAS Name: N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide IUPAC Name: N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Traditional Name: N-[4-methoxy-3-(4-pyridylmethoxy)phenyl]-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide Formula: C26H22N2O3S MolecularWeight: 442.52948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3)OCC5=CC=NC=C5

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3)OCC5=CC=NC=C5

InChI

InChI=1S/C26H22N2O3S/c1-30-22-9-8-20(15-23(22)31-16-17-10-12-27-13-11-17)28-26(29)24-14-19-7-6-18-4-2-3-5-21(18)25(19)32-24/h2-5,8-15H,6-7,16H2,1H3,(H,28,29)