3-(1H-indol-3-yl)-N-[(E)-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]methylideneamino]propanamide

Systemtic Name: 3-(1H-indol-3-yl)-N-[(E)-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]methylideneamino]propanamide Openeye Name: 3-(1H-indol-3-yl)-N-[(E)-[4-methoxy-3-(2-pyridylsulfanylmethyl)phenyl]methyleneamino]propanamide CAS Name: 3-(1H-indol-3-yl)-N-[(E)-[4-methoxy-3-[(2-pyridinylthio)methyl]phenyl]methylideneamino]propanamide IUPAC Name: 3-(1H-indol-3-yl)-N-[(E)-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]methylideneamino]propanamide Traditional Name: 3-(1H-indol-3-yl)-N-[(E)-[4-methoxy-3-[(2-pyridylthio)methyl]benzylidene]amino]propionamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)CCC2=CNC3=CC=CC=C32)CSC4=CC=CC=N4

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)CCC2=CNC3=CC=CC=C32)CSC4=CC=CC=N4

InChI

InChI=1S/C25H24N4O2S/c1-31-23-11-9-18(14-20(23)17-32-25-8-4-5-13-26-25)15-28-29-24(30)12-10-19-16-27-22-7-3-2-6-21(19)22/h2-9,11,13-16,27H,10,12,17H2,1H3,(H,29,30)/b28-15+