2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(1,3-diphenylpyrazol-4-yl)methyleneamino]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-(1,3-diphenyl-4-pyrazolyl)methylideneamino]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-(1,3-diphenylpyrazol-4-yl)methyleneamino]acetamide Formula: C25H19N5OS2 MolecularWeight: 469.58126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=NNC(=O)CSC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=N/NC(=O)CSC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

InChI

InChI=1S/C25H19N5OS2/c31-23(17-32-25-27-21-13-7-8-14-22(21)33-25)28-26-15-19-16-30(20-11-5-2-6-12-20)29-24(19)18-9-3-1-4-10-18/h1-16H,17H2,(H,28,31)/b26-15+