5-methylsulfanyl-4-(3-piperidin-1-ylphenyl)sulfonyl-thiophene-2-carbonitrile

Systemtic Name: 5-methylsulfanyl-4-(3-piperidin-1-ylphenyl)sulfonyl-thiophene-2-carbonitrile Openeye Name: 5-methylsulfanyl-4-[3-(1-piperidyl)phenyl]sulfonyl-thiophene-2-carbonitrile CAS Name: 5-(methylthio)-4-[3-(1-piperidinyl)phenyl]sulfonyl-2-thiophenecarbonitrile IUPAC Name: 5-methylsulfanyl-4-(3-piperidin-1-ylphenyl)sulfonylthiophene-2-carbonitrile Traditional Name: 5-(methylthio)-4-(3-piperidinophenyl)sulfonyl-thiophene-2-carbonitrile Formula: C17H18N2O2S3 MolecularWeight: 378.53202

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(S1)C#N)S(=O)(=O)C2=CC=CC(=C2)N3CCCCC3

Isomeric SMILES

CSC1=C(C=C(S1)C#N)S(=O)(=O)C2=CC=CC(=C2)N3CCCCC3

InChI

InChI=1S/C17H18N2O2S3/c1-22-17-16(11-14(12-18)23-17)24(20,21)15-7-5-6-13(10-15)19-8-3-2-4-9-19/h5-7,10-11H,2-4,8-9H2,1H3