4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(E)-(4-cyanophenyl)methylideneamino]benzamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(E)-(4-cyanophenyl)methylideneamino]benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(E)-(4-cyanophenyl)methyleneamino]benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[(E)-(4-cyanophenyl)methylideneamino]benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(E)-(4-cyanophenyl)methylideneamino]benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[(E)-(4-cyanobenzylidene)amino]benzamide Formula: C23H16N4OS2 MolecularWeight: 428.52934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=C(C=C3)C(=O)NN=CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=C(C=C3)C(=O)N/N=C/C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H16N4OS2/c24-13-16-5-7-17(8-6-16)14-25-27-22(28)19-11-9-18(10-12-19)15-29-23-26-20-3-1-2-4-21(20)30-23/h1-12,14H,15H2,(H,27,28)/b25-14+