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

Systemtic Name: 5-(3-chlorophenyl)-3-[(2-methoxyphenyl)methylsulfanyl]-1,2-oxazole-4-carbonitrile Openeye Name: 5-(3-chlorophenyl)-3-[(2-methoxyphenyl)methylsulfanyl]isoxazole-4-carbonitrile CAS Name: 5-(3-chlorophenyl)-3-[(2-methoxyphenyl)methylthio]-4-isoxazolecarbonitrile IUPAC Name: 5-(3-chlorophenyl)-3-[(2-methoxyphenyl)methylsulfanyl]-1,2-oxazole-4-carbonitrile Traditional Name: 5-(3-chlorophenyl)-3-(o-anisylthio)isoxazole-4-carbonitrile Formula: C18H13ClN2O2S MolecularWeight: 356.82602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CSC2=NOC(=C2C#N)C3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=CC=C1CSC2=NOC(=C2C#N)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H13ClN2O2S/c1-22-16-8-3-2-5-13(16)11-24-18-15(10-20)17(23-21-18)12-6-4-7-14(19)9-12/h2-9H,11H2,1H3