4,5-diphenyl-1,3-oxazole; 2-methyl-2-sulfanyl-propanenitrile

Systemtic Name: 4,5-diphenyl-1,3-oxazole; 2-methyl-2-sulfanyl-propanenitrile Openeye Name: 4,5-diphenyloxazole; 2-methyl-2-sulfanyl-propanenitrile CAS Name: 4,5-diphenyloxazole; 2-mercapto-2-methylpropanenitrile IUPAC Name: 4,5-diphenyl-1,3-oxazole; 2-methyl-2-sulfanylpropanenitrile Traditional Name: 4,5-diphenyloxazole; 2-mercapto-2-methyl-propionitrile Formula: C19H18N2OS MolecularWeight: 322.42402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)S.C1=CC=C(C=C1)C2=C(OC=N2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C#N)S.C1=CC=C(C=C1)C2=C(OC=N2)C3=CC=CC=C3

InChI

InChI=1S/C15H11NO.C4H7NS/c1-3-7-12(8-4-1)14-15(17-11-16-14)13-9-5-2-6-10-13;1-4(2,6)3-5/h1-11H;6H,1-2H3