3-(2-chloranyl-4-methoxy-phenoxy)-6-methylsulfonyl-1-benzothiophene-2-carbonitrile

Systemtic Name: 3-(2-chloranyl-4-methoxy-phenoxy)-6-methylsulfonyl-1-benzothiophene-2-carbonitrile Openeye Name: 3-(2-chloro-4-methoxy-phenoxy)-6-methylsulfonyl-benzothiophene-2-carbonitrile CAS Name: 3-(2-chloro-4-methoxyphenoxy)-6-methylsulfonyl-1-benzothiophene-2-carbonitrile IUPAC Name: 3-(2-chloro-4-methoxyphenoxy)-6-methylsulfonyl-1-benzothiophene-2-carbonitrile Traditional Name: 3-(2-chloro-4-methoxy-phenoxy)-6-mesyl-benzothiophene-2-carbonitrile Formula: C17H12ClNO4S2 MolecularWeight: 393.86448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC2=C(SC3=C2C=CC(=C3)S(=O)(=O)C)C#N)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC2=C(SC3=C2C=CC(=C3)S(=O)(=O)C)C#N)Cl

InChI

InChI=1S/C17H12ClNO4S2/c1-22-10-3-6-14(13(18)7-10)23-17-12-5-4-11(25(2,20)21)8-15(12)24-16(17)9-19/h3-8H,1-2H3