N-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]pyridine-4-carboxamide

Systemtic Name: N-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]pyridine-4-carboxamide Openeye Name: N-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]pyridine-4-carboxamide CAS Name: N-[(Z)-1-[4-methoxy-3-[(2-pyrimidinylthio)methyl]phenyl]ethylideneamino]-4-pyridinecarboxamide IUPAC Name: N-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]pyridine-4-carboxamide Traditional Name: N-[(Z)-1-[4-methoxy-3-[(2-pyrimidylthio)methyl]phenyl]ethylideneamino]isonicotinamide Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=NC=C1)C2=CC(=C(C=C2)OC)CSC3=NC=CC=N3

Isomeric SMILES

C/C(=N/NC(=O)C1=CC=NC=C1)/C2=CC(=C(C=C2)OC)CSC3=NC=CC=N3

InChI

InChI=1S/C20H19N5O2S/c1-14(24-25-19(26)15-6-10-21-11-7-15)16-4-5-18(27-2)17(12-16)13-28-20-22-8-3-9-23-20/h3-12H,13H2,1-2H3,(H,25,26)/b24-14-