7-(4-methoxyphenyl)-5-methylsulfanyl-2-phenyl-1,3-benzothiazole-4-carbonitrile

Systemtic Name: 7-(4-methoxyphenyl)-5-methylsulfanyl-2-phenyl-1,3-benzothiazole-4-carbonitrile Openeye Name: 7-(4-methoxyphenyl)-5-methylsulfanyl-2-phenyl-1,3-benzothiazole-4-carbonitrile CAS Name: 7-(4-methoxyphenyl)-5-(methylthio)-2-phenyl-1,3-benzothiazole-4-carbonitrile IUPAC Name: 7-(4-methoxyphenyl)-5-methylsulfanyl-2-phenyl-1,3-benzothiazole-4-carbonitrile Traditional Name: 7-(4-methoxyphenyl)-5-(methylthio)-2-phenyl-1,3-benzothiazole-4-carbonitrile Formula: C22H16N2OS2 MolecularWeight: 388.50524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=C(C3=C2SC(=N3)C4=CC=CC=C4)C#N)SC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=C(C3=C2SC(=N3)C4=CC=CC=C4)C#N)SC

InChI

InChI=1S/C22H16N2OS2/c1-25-16-10-8-14(9-11-16)17-12-19(26-2)18(13-23)20-21(17)27-22(24-20)15-6-4-3-5-7-15/h3-12H,1-2H3