N-[(E)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]-1H-indole-3-carboxamide

Systemtic Name: N-[(E)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]-1H-indole-3-carboxamide Openeye Name: N-[(E)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]-1H-indole-3-carboxamide CAS Name: N-[(E)-1-[4-methoxy-3-[(2-pyrimidinylthio)methyl]phenyl]ethylideneamino]-1H-indole-3-carboxamide IUPAC Name: N-[(E)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]-1H-indole-3-carboxamide Traditional Name: N-[(E)-1-[4-methoxy-3-[(2-pyrimidylthio)methyl]phenyl]ethylideneamino]-1H-indole-3-carboxamide Formula: C23H21N5O2S MolecularWeight: 431.51014

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CNC2=CC=CC=C21)C3=CC(=C(C=C3)OC)CSC4=NC=CC=N4

Isomeric SMILES

C/C(=N\NC(=O)C1=CNC2=CC=CC=C21)/C3=CC(=C(C=C3)OC)CSC4=NC=CC=N4

InChI

InChI=1S/C23H21N5O2S/c1-15(27-28-22(29)19-13-26-20-7-4-3-6-18(19)20)16-8-9-21(30-2)17(12-16)14-31-23-24-10-5-11-25-23/h3-13,26H,14H2,1-2H3,(H,28,29)/b27-15+