3-[(4-tert-butylphenyl)sulfanylmethyl]-5-(3,4-dichlorophenyl)-1,2-oxazole

Systemtic Name: 3-[(4-tert-butylphenyl)sulfanylmethyl]-5-(3,4-dichlorophenyl)-1,2-oxazole Openeye Name: 3-[(4-tert-butylphenyl)sulfanylmethyl]-5-(3,4-dichlorophenyl)isoxazole CAS Name: 3-[[(4-tert-butylphenyl)thio]methyl]-5-(3,4-dichlorophenyl)isoxazole IUPAC Name: 3-[(4-tert-butylphenyl)sulfanylmethyl]-5-(3,4-dichlorophenyl)-1,2-oxazole Traditional Name: 3-[[(4-tert-butylphenyl)thio]methyl]-5-(3,4-dichlorophenyl)isoxazole Formula: C20H19Cl2NOS MolecularWeight: 392.34196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC2=NOC(=C2)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC2=NOC(=C2)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H19Cl2NOS/c1-20(2,3)14-5-7-16(8-6-14)25-12-15-11-19(24-23-15)13-4-9-17(21)18(22)10-13/h4-11H,12H2,1-3H3