methyl 2-[[(3E)-3-(2-thiophen-2-ylethanoylhydrazinylidene)butanoyl]amino]benzoate

Systemtic Name: methyl 2-[[(3E)-3-(2-thiophen-2-ylethanoylhydrazinylidene)butanoyl]amino]benzoate Openeye Name: methyl 2-[[(3E)-3-[[2-(2-thienyl)acetyl]hydrazono]butanoyl]amino]benzoate CAS Name: 2-[[(3E)-1-oxo-3-[(1-oxo-2-thiophen-2-ylethyl)hydrazinylidene]butyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(3E)-3-[(2-thiophen-2-ylacetyl)hydrazinylidene]butanoyl]amino]benzoate Traditional Name: 2-[[(3E)-3-[[2-(2-thienyl)acetyl]hydrazono]butanoyl]amino]benzoic acid methyl ester Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CC1=CC=CS1)CC(=O)NC2=CC=CC=C2C(=O)OC

Isomeric SMILES

C/C(=N\NC(=O)CC1=CC=CS1)/CC(=O)NC2=CC=CC=C2C(=O)OC

InChI

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