N-(3-cyanothiophen-2-yl)-3-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-3-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide Openeye Name: N-(3-cyano-2-thienyl)-3-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide CAS Name: N-(3-cyano-2-thiophenyl)-3-[methyl-[[4-(methylthio)phenyl]methyl]amino]propanamide IUPAC Name: N-(3-cyanothiophen-2-yl)-3-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propanamide Traditional Name: N-(3-cyano-2-thienyl)-3-[methyl-[4-(methylthio)benzyl]amino]propionamide Formula: C17H19N3OS2 MolecularWeight: 345.48226

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)NC1=C(C=CS1)C#N)CC2=CC=C(C=C2)SC

Isomeric SMILES

CN(CCC(=O)NC1=C(C=CS1)C#N)CC2=CC=C(C=C2)SC

InChI

InChI=1S/C17H19N3OS2/c1-20(12-13-3-5-15(22-2)6-4-13)9-7-16(21)19-17-14(11-18)8-10-23-17/h3-6,8,10H,7,9,12H2,1-2H3,(H,19,21)