5-(3-chlorophenyl)-3-[(2-methylphenyl)methylsulfanyl]-1,2-oxazole-4-carbonitrile

Systemtic Name: 5-(3-chlorophenyl)-3-[(2-methylphenyl)methylsulfanyl]-1,2-oxazole-4-carbonitrile Openeye Name: 5-(3-chlorophenyl)-3-(o-tolylmethylsulfanyl)isoxazole-4-carbonitrile CAS Name: 5-(3-chlorophenyl)-3-[(2-methylphenyl)methylthio]-4-isoxazolecarbonitrile IUPAC Name: 5-(3-chlorophenyl)-3-[(2-methylphenyl)methylsulfanyl]-1,2-oxazole-4-carbonitrile Traditional Name: 5-(3-chlorophenyl)-3-[(2-methylbenzyl)thio]isoxazole-4-carbonitrile Formula: C18H13ClN2OS MolecularWeight: 340.82662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NOC(=C2C#N)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1CSC2=NOC(=C2C#N)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H13ClN2OS/c1-12-5-2-3-6-14(12)11-23-18-16(10-20)17(22-21-18)13-7-4-8-15(19)9-13/h2-9H,11H2,1H3