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

Systemtic Name: N-[(E)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]-2-methyl-furan-3-carboxamide Openeye Name: N-[(E)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]-2-methyl-furan-3-carboxamide CAS Name: N-[(E)-1-[4-methoxy-3-[(2-pyrimidinylthio)methyl]phenyl]ethylideneamino]-2-methyl-3-furancarboxamide IUPAC Name: N-[(E)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]-2-methylfuran-3-carboxamide Traditional Name: N-[(E)-1-[4-methoxy-3-[(2-pyrimidylthio)methyl]phenyl]ethylideneamino]-2-methyl-3-furamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)NN=C(C)C2=CC(=C(C=C2)OC)CSC3=NC=CC=N3

Isomeric SMILES

CC1=C(C=CO1)C(=O)N/N=C(\C)/C2=CC(=C(C=C2)OC)CSC3=NC=CC=N3

InChI

InChI=1S/C20H20N4O3S/c1-13(23-24-19(25)17-7-10-27-14(17)2)15-5-6-18(26-3)16(11-15)12-28-20-21-8-4-9-22-20/h4-11H,12H2,1-3H3,(H,24,25)/b23-13+