2-[[2-methoxy-5-[(Z)-C-methyl-N-(pyridin-3-ylcarbonylamino)carbonimidoyl]phenyl]methylsulfanyl]ethanoate

Systemtic Name: 2-[[2-methoxy-5-[(Z)-C-methyl-N-(pyridin-3-ylcarbonylamino)carbonimidoyl]phenyl]methylsulfanyl]ethanoate Openeye Name: 2-[[2-methoxy-5-[(Z)-C-methyl-N-(pyridine-3-carbonylamino)carbonimidoyl]phenyl]methylsulfanyl]acetate CAS Name: 2-[[2-methoxy-5-[(1Z)-1-[[oxo(3-pyridinyl)methyl]hydrazinylidene]ethyl]phenyl]methylthio]acetate IUPAC Name: 2-[[2-methoxy-5-[(Z)-C-methyl-N-(pyridine-3-carbonylamino)carbonimidoyl]phenyl]methylsulfanyl]acetate Traditional Name: 2-[[2-methoxy-5-[(Z)-C-methyl-N-nicotinamido-carbonimidoyl]benzyl]thio]acetate Formula: C18H18N3O4S- MolecularWeight: 372.41822

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CN=CC=C1)C2=CC(=C(C=C2)OC)CSCC(=O)[O-]

Isomeric SMILES

C/C(=N/NC(=O)C1=CN=CC=C1)/C2=CC(=C(C=C2)OC)CSCC(=O)[O-]

InChI

InChI=1S/C18H19N3O4S/c1-12(20-21-18(24)14-4-3-7-19-9-14)13-5-6-16(25-2)15(8-13)10-26-11-17(22)23/h3-9H,10-11H2,1-2H3,(H,21,24)(H,22,23)/p-1/b20-12-