[4-[(E)-[[(Z)-2-benzamido-3-thiophen-2-yl-prop-2-enoyl]hydrazinylidene]methyl]-2-ethoxy-phenyl] benzoate

Systemtic Name: [4-[(E)-[[(Z)-2-benzamido-3-thiophen-2-yl-prop-2-enoyl]hydrazinylidene]methyl]-2-ethoxy-phenyl] benzoate Openeye Name: [4-[(E)-[[(Z)-2-benzamido-3-(2-thienyl)prop-2-enoyl]hydrazono]methyl]-2-ethoxy-phenyl] benzoate CAS Name: benzoic acid [4-[(E)-[[(Z)-2-benzamido-1-oxo-3-thiophen-2-ylprop-2-enyl]hydrazinylidene]methyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[(E)-[[(Z)-2-benzamido-3-thiophen-2-ylprop-2-enoyl]hydrazinylidene]methyl]-2-ethoxyphenyl] benzoate Traditional Name: benzoic acid [4-[(E)-[[(Z)-2-benzamido-3-(2-thienyl)acryloyl]hydrazono]methyl]-2-ethoxy-phenyl] ester Formula: C30H25N3O5S MolecularWeight: 539.6016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=O)C(=CC2=CC=CS2)NC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N/NC(=O)/C(=C/C2=CC=CS2)/NC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H25N3O5S/c1-2-37-27-18-21(15-16-26(27)38-30(36)23-12-7-4-8-13-23)20-31-33-29(35)25(19-24-14-9-17-39-24)32-28(34)22-10-5-3-6-11-22/h3-20H,2H2,1H3,(H,32,34)(H,33,35)/b25-19-,31-20+