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

Systemtic Name: N-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]-2-phenylazanyl-ethanamide Openeye Name: 2-anilino-N-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]acetamide CAS Name: 2-anilino-N-[(Z)-1-[4-methoxy-3-[(2-pyrimidinylthio)methyl]phenyl]ethylideneamino]acetamide IUPAC Name: 2-anilino-N-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]acetamide Traditional Name: 2-anilino-N-[(Z)-1-[4-methoxy-3-[(2-pyrimidylthio)methyl]phenyl]ethylideneamino]acetamide Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CNC1=CC=CC=C1)C2=CC(=C(C=C2)OC)CSC3=NC=CC=N3

Isomeric SMILES

C/C(=N/NC(=O)CNC1=CC=CC=C1)/C2=CC(=C(C=C2)OC)CSC3=NC=CC=N3

InChI

InChI=1S/C22H23N5O2S/c1-16(26-27-21(28)14-25-19-7-4-3-5-8-19)17-9-10-20(29-2)18(13-17)15-30-22-23-11-6-12-24-22/h3-13,25H,14-15H2,1-2H3,(H,27,28)/b26-16-