2-methylsulfanyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide

Systemtic Name: 2-methylsulfanyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Openeye Name: 2-methylsulfanyl-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]benzamide CAS Name: 2-(methylthio)-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]benzamide IUPAC Name: 2-methylsulfanyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Traditional Name: 2-(methylthio)-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]benzamide Formula: C17H20N2O3S3 MolecularWeight: 396.5473

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H20N2O3S3/c1-23-15-7-3-2-6-14(15)17(20)18-12-13-8-9-16(24-13)25(21,22)19-10-4-5-11-19/h2-3,6-9H,4-5,10-12H2,1H3,(H,18,20)