3-methoxy-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]benzamide

Systemtic Name: 3-methoxy-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]benzamide Openeye Name: 3-methoxy-N-[(E)-[4-methoxy-3-(thiomorpholinomethyl)phenyl]methyleneamino]benzamide CAS Name: 3-methoxy-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]benzamide IUPAC Name: 3-methoxy-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]benzamide Traditional Name: 3-methoxy-N-[(E)-[4-methoxy-3-(thiomorpholinomethyl)benzylidene]amino]benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2=CC(=CC=C2)OC)CN3CCSCC3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)C2=CC(=CC=C2)OC)CN3CCSCC3

InChI

InChI=1S/C21H25N3O3S/c1-26-19-5-3-4-17(13-19)21(25)23-22-14-16-6-7-20(27-2)18(12-16)15-24-8-10-28-11-9-24/h3-7,12-14H,8-11,15H2,1-2H3,(H,23,25)/b22-14+