3-(4-methoxyphenyl)sulfanyl-6-methylsulfonyl-1-benzofuran-2-carbonitrile

Systemtic Name: 3-(4-methoxyphenyl)sulfanyl-6-methylsulfonyl-1-benzofuran-2-carbonitrile Openeye Name: 3-(4-methoxyphenyl)sulfanyl-6-methylsulfonyl-benzofuran-2-carbonitrile CAS Name: 3-[(4-methoxyphenyl)thio]-6-methylsulfonyl-2-benzofurancarbonitrile IUPAC Name: 3-(4-methoxyphenyl)sulfanyl-6-methylsulfonyl-1-benzofuran-2-carbonitrile Traditional Name: 6-mesyl-3-[(4-methoxyphenyl)thio]coumarilonitrile Formula: C17H13NO4S2 MolecularWeight: 359.41942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=C(OC3=C2C=CC(=C3)S(=O)(=O)C)C#N

Isomeric SMILES

COC1=CC=C(C=C1)SC2=C(OC3=C2C=CC(=C3)S(=O)(=O)C)C#N

InChI

InChI=1S/C17H13NO4S2/c1-21-11-3-5-12(6-4-11)23-17-14-8-7-13(24(2,19)20)9-15(14)22-16(17)10-18/h3-9H,1-2H3