3-[4-(5-methyl-2-phenyl-phenyl)-1-oxidanylidene-2-phenyl-1,2,3,5-thiatriazol-5-yl]propanenitrile

Systemtic Name: 3-[4-(5-methyl-2-phenyl-phenyl)-1-oxidanylidene-2-phenyl-1,2,3,5-thiatriazol-5-yl]propanenitrile Openeye Name: 3-[4-(5-methyl-2-phenyl-phenyl)-1-oxo-2-phenyl-1,2,3,5-thiatriazol-5-yl]propanenitrile CAS Name: 3-[4-(5-methyl-2-phenylphenyl)-1-oxo-2-phenyl-1,2,3,5-thiatriazol-5-yl]propanenitrile IUPAC Name: 3-[4-(5-methyl-2-phenylphenyl)-1-oxo-2-phenyl-1,2,3,5-thiatriazol-5-yl]propanenitrile Traditional Name: 3-[1-keto-4-(5-methyl-2-phenyl-phenyl)-2-phenyl-1,2,3,5-thiatriazol-5-yl]propionitrile Formula: C23H20N4OS MolecularWeight: 400.4961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC=CC=C2)C3=NN(S(=O)N3CCC#N)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC=CC=C2)C3=NN(S(=O)N3CCC#N)C4=CC=CC=C4

InChI

InChI=1S/C23H20N4OS/c1-18-13-14-21(19-9-4-2-5-10-19)22(17-18)23-25-27(20-11-6-3-7-12-20)29(28)26(23)16-8-15-24/h2-7,9-14,17H,8,16H2,1H3