3-[(4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[(4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[(4-phenylthiazol-2-yl)sulfanylmethyl]benzonitrile CAS Name: 3-[[(4-phenyl-2-thiazolyl)thio]methyl]benzonitrile IUPAC Name: 3-[(4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 3-[[(4-phenylthiazol-2-yl)thio]methyl]benzonitrile Formula: C17H12N2S2 MolecularWeight: 308.42058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)SCC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)SCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H12N2S2/c18-10-13-5-4-6-14(9-13)11-20-17-19-16(12-21-17)15-7-2-1-3-8-15/h1-9,12H,11H2